| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 37.2 | Very low | 57.8 | Low | 249 Ų | 249 | 94.6 Ų | 94.6 | 100% | 1.227 | 50% | 0.502 | S | S | * | . | 0 | 101 | 0 | -75.4 | 164.6 | 163 | 0 | 0 | 108.7 | |||||
| 2 | G | 42.8 | Very low | 58.7 | Low | 51 Ų | 51 | 99.8 Ų | 99.8 | 53% | 0.526 | 51% | 0.509 | S | S | . | . | trans | -172.4 | 27.2 | -173 | 0 | 0 | 0 | 0 | 0 | 114.4 | W5 | G2-W5 PolarHBondContact O-NE1 3.38Š| ||
| 3 | G | 43.3 | Very low | 59.5 | Low | 37 Ų | 37 | 98.2 Ų | 98.2 | 38% | 0.381 | 50% | 0.501 | S | S | . | . | trans | -99.7 | -29 | 179 | 0 | 0 | 0 | 0 | 0 | 114.1 | W5 W6 W7 | G3-W5 PolarHBondContact O-N 3.18Å; G3-W6 PolarHBondContact O-N 2.99Å; G3-W6 VanDerWaalsContact O-N 3.17Å; G3-W7 PolarHBondContact O-N 3.19Å | ||
| 4 | G | 53.5 | Low | 59.8 | Low | 54 Ų | 54 | 94.7 Ų | 94.7 | 56% | 0.557 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.8 | -37.4 | -165.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | W6 W7 A8 | G4-W6 VanDerWaalsContact C-N 3.34Å; G4-W6 PolarHBondContact O-N 3.08Å; G4-W7 PolarHBondContact O-N 3.13Å; G4-A8 WeakPolarHBondContact O-CB 3.5Å; G4-A8 PolarHBondContact O-N 3.48Å |
| 5 | W | 61.8 | Low | 59.9 | Low | 199 Ų | 199 | 98.8 Ų | 98.8 | 75% | 0.754 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -66.1 | -30.5 | 177.1 | 33.3 | 29 | 0 | 0 | 0 | 114.1 | G2 G3 R9 | G2-W5 PolarHBondContact O-NE1 3.38Å; G3-W5 PolarHBondContact O-N 3.18Å; W5-R9 WeakPolarHBondContact O-CB 3.45Å; W5-R9 PolarHBondContact O-N 3.44Å |
| 6 | W | 63.2 | Low | 59.9 | Low | 82 Ų | 82 | 100 Ų | 100 | 31% | 0.311 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -73.6 | -46.3 | 176.7 | -177.4 | 85.3 | 0 | 0 | 0 | 110.1 | G3 G4 A8 R9 V10 | G3-W6 PolarHBondContact O-N 2.99Å; G3-W6 VanDerWaalsContact O-N 3.17Å; G4-W6 VanDerWaalsContact C-N 3.34Å; G4-W6 PolarHBondContact O-N 3.08Å; W6-A8 VanDerWaalsContact C-N 3.34Å; W6-A8 PolarHBondContact O-N 3.17Å; W6-R9 PolarHBondContact O-N 3.49Å; W6-R9 VanDerWaalsContact O-N 3.1Å; W6-V10 HydrophobicContact CD2-CG2 4.14Å; W6-V10 HydrophobicContact CE3-CG2 4.33Å; W6-V10 HydrophobicContact CH2-CG2 4.31Å; W6-V10 HydrophobicContact CZ2-CG2 4.11Å; W6-V10 HydrophobicContact CZ3-CG2 4.41Å; W6-V10 WeakPolarHBondContact O-CG2 3.4Å; W6-V10 PolarHBondContact O-N 3.46Å |
| 7 | W | 60.9 | Low | 59.8 | Low | 94 Ų | 94 | 106.5 Ų | 106.5 | 36% | 0.356 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.3 | -39.4 | 173.7 | -68.1 | 110.4 | 0 | 0 | 0 | 112.7 | G3 G4 R9 V10 A11 W112 | G3-W7 PolarHBondContact O-N 3.19Å; G4-W7 PolarHBondContact O-N 3.13Å; W7-R9 VanDerWaalsContact C-N 3.28Å; W7-R9 PolarHBondContact O-N 2.72Å; W7-V10 PolarHBondContact O-N 2.99Å; W7-A11 VanDerWaalsContact O-CB 3.22Å; W7-A11 WeakPolarHBondContact O-CB 3.37Å; W7-A11 PolarHBondContact O-N 2.87Å; W7-W112 AromaticContact CE2-CZ2 3.99Å; W7-W112 HydrophobicContact CH2-CH2 4.48Å; W7-W112 HydrophobicContact CH2-CZ2 4.17Å; W7-W112 AromaticContact CZ2-CE2 4Å; W7-W112 HydrophobicContact CZ2-CH2 4.09Å; W7-W112 AromaticContact CZ2-CZ2 3.41Å; W7-W112 HydrophobicContact CZ2-CZ2 3.41Å; W7-W112 VanDerWaalsContact CZ2-CZ2 3.41Å |
| 8 | A | 66.7 | Low | 59.4 | Low | 38 Ų | 38 | 109.1 Ų | 109.1 | 31% | 0.314 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.1 | -32.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | G4 W6 R12 | G4-A8 WeakPolarHBondContact O-CB 3.5Å; G4-A8 PolarHBondContact O-N 3.48Å; W6-A8 VanDerWaalsContact C-N 3.34Å; W6-A8 PolarHBondContact O-N 3.17Å; A8-R12 WeakPolarHBondContact O-CB 3.22Å; A8-R12 PolarHBondContact O-N 2.95Å; A8-R12 VanDerWaalsContact O-N 3.15Å |
| 9 | R | 68.8 | Low | 58.8 | Low | 184 Ų | 184 | 114 Ų | 114 | 69% | 0.694 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -76.5 | -44 | 177.4 | -161.8 | 173.3 | -173.2 | 135.8 | -2.3 | 111.4 | W5 W6 W7 R12 L13 | W5-R9 WeakPolarHBondContact O-CB 3.45Å; W5-R9 PolarHBondContact O-N 3.44Å; W6-R9 PolarHBondContact O-N 3.49Å; W6-R9 VanDerWaalsContact O-N 3.1Å; W7-R9 VanDerWaalsContact C-N 3.28Å; W7-R9 PolarHBondContact O-N 2.72Å; R9-R12 WeakPolarHBondContact O-CB 3.43Å; R9-R12 PolarHBondContact O-N 3.31Å; R9-L13 WeakPolarHBondContact O-CG 3.3Å; R9-L13 PolarHBondContact O-N 3.45Å |
| 10 | V | 68.9 | Low | 58.1 | Low | 18 Ų | 18 | 111.1 Ų | 111.1 | 11% | 0.109 | 55% | 0.547 | C | S | . | . | H | α-helix | trans | -60.8 | -45.9 | 173.6 | 173.8 | 0 | 0 | 0 | 0 | 110.9 | W6 W7 R12 L13 A14 V119 A123 | W6-V10 HydrophobicContact CD2-CG2 4.14Å; W6-V10 HydrophobicContact CE3-CG2 4.33Å; W6-V10 HydrophobicContact CH2-CG2 4.31Å; W6-V10 HydrophobicContact CZ2-CG2 4.11Å; W6-V10 HydrophobicContact CZ3-CG2 4.41Å; W6-V10 WeakPolarHBondContact O-CG2 3.4Å; W6-V10 PolarHBondContact O-N 3.46Å; W7-V10 PolarHBondContact O-N 2.99Å; V10-R12 VanDerWaalsContact C-N 3.29Å; V10-R12 PolarHBondContact O-N 3.1Å; V10-L13 PolarHBondContact O-N 3Å; V10-A14 WeakPolarHBondContact O-CB 3.45Å; V10-A14 PolarHBondContact O-N 3.32Å; V10-V119 HydrophobicContact CG1-CG1 4.48Å; V10-A123 HydrophobicContact CG1-CB 4.33Å |
| 11 | A | 68.6 | Low | 57.5 | Low | 35 Ų | 35 | 109.8 Ų | 109.8 | 29% | 0.289 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -62.7 | -34.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | W7 R15 | W7-A11 VanDerWaalsContact O-CB 3.22Å; W7-A11 WeakPolarHBondContact O-CB 3.37Å; W7-A11 PolarHBondContact O-N 2.87Å; A11-R15 WeakPolarHBondContact O-CB 3.4Å; A11-R15 VanDerWaalsContact O-CG 3.3Å; A11-R15 WeakPolarHBondContact O-CG 3.48Å; A11-R15 PolarHBondContact O-N 3.26Å; A11-R15 PolarHBondContact O-NE 3.48Å |
| 12 | R | 69.3 | Low | 57.8 | Low | 157 Ų | 157 | 104.3 Ų | 104.3 | 59% | 0.592 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -65.9 | -44.5 | 174.8 | -132 | 178.1 | -64.5 | -116.2 | 3.1 | 111.6 | A8 R9 V10 R15 L16 | A8-R12 WeakPolarHBondContact O-CB 3.22Å; A8-R12 PolarHBondContact O-N 2.95Å; A8-R12 VanDerWaalsContact O-N 3.15Å; R9-R12 WeakPolarHBondContact O-CB 3.43Å; R9-R12 PolarHBondContact O-N 3.31Å; V10-R12 VanDerWaalsContact C-N 3.29Å; V10-R12 PolarHBondContact O-N 3.1Å; R12-R15 PolarHBondContact O-N 3.15Å; R12-L16 WeakPolarHBondContact O-CG 3.33Å; R12-L16 PolarHBondContact O-N 3.41Å; R12-L16 VanDerWaalsContact O-N 3.1Å |
| 13 | L | 68.9 | Low | 57.8 | Low | 78 Ų | 78 | 108.6 Ų | 108.6 | 41% | 0.408 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -68.5 | -40.2 | 178.8 | -68.9 | 170.1 | 0 | 0 | 0 | 112.1 | R9 V10 R15 L16 R17 | R9-L13 WeakPolarHBondContact O-CG 3.3Å; R9-L13 PolarHBondContact O-N 3.45Å; V10-L13 PolarHBondContact O-N 3Å; L13-R15 PolarHBondContact O-N 3.35Å; L13-L16 PolarHBondContact O-N 3.05Å; L13-R17 PolarHBondContact O-N 2.86Å; L13-R17 VanDerWaalsContact O-N 3.09Å |
| 14 | A | 64 | Low | 57.8 | Low | 50 Ų | 50 | 111.7 Ų | 111.7 | 41% | 0.413 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -61.6 | -42 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | V10 R17 F18 | V10-A14 WeakPolarHBondContact O-CB 3.45Å; V10-A14 PolarHBondContact O-N 3.32Å; A14-R17 PolarHBondContact O-N 3.09Å; A14-F18 PolarHBondContact O-N 2.8Å |
| 15 | R | 60.7 | Low | 57.3 | Low | 156 Ų | 156 | 115.1 Ų | 115.1 | 59% | 0.589 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -63.8 | -38.9 | 175.6 | -79.6 | -176.1 | -71.7 | -119 | 0.3 | 113.1 | A11 R12 L13 R17 F18 R19 | A11-R15 WeakPolarHBondContact O-CB 3.4Å; A11-R15 VanDerWaalsContact O-CG 3.3Å; A11-R15 WeakPolarHBondContact O-CG 3.48Å; A11-R15 PolarHBondContact O-N 3.26Å; A11-R15 PolarHBondContact O-NE 3.48Å; R12-R15 PolarHBondContact O-N 3.15Å; L13-R15 PolarHBondContact O-N 3.35Å; R15-R17 VanDerWaalsContact C-N 3.34Å; R15-F18 PolarHBondContact O-N 3.21Å; R15-R19 WeakPolarHBondContact O-CB 3.41Å; R15-R19 PolarHBondContact O-N 3.21Å |
| 16 | L | 59.4 | Low | 56.2 | Low | 118 Ų | 118 | 114.5 Ų | 114.5 | 62% | 0.618 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -66.4 | -37.7 | 176.8 | -71.4 | 166.9 | 0 | 0 | 0 | 111.6 | R12 L13 G20 | R12-L16 WeakPolarHBondContact O-CG 3.33Å; R12-L16 PolarHBondContact O-N 3.41Å; R12-L16 VanDerWaalsContact O-N 3.1Å; L13-L16 PolarHBondContact O-N 3.05Å; L16-G20 PolarHBondContact O-N 2.85Å; L16-G20 VanDerWaalsContact O-N 3.17Å |
| 17 | R | 59.1 | Low | 55.1 | Low | 211 Ų | 211 | 121.4 Ų | 121.4 | 80% | 0.796 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -68.4 | -39 | 175.9 | -166.6 | 174.7 | 172.6 | 94 | 1 | 112.6 | L13 A14 R15 G20 S21 | L13-R17 PolarHBondContact O-N 2.86Å; L13-R17 VanDerWaalsContact O-N 3.09Å; A14-R17 PolarHBondContact O-N 3.09Å; R15-R17 VanDerWaalsContact C-N 3.34Å; R17-G20 PolarHBondContact O-N 3.44Å; R17-S21 PolarHBondContact O-N 3.38Å; R17-S21 PolarHBondContact O-OG 3.18Å |
| 18 | F | 52.2 | Low | 54.2 | Low | 152 Ų | 152 | 123 Ų | 123 | 67% | 0.667 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -72.3 | -30.2 | 175.9 | -101.3 | -85 | 0 | 0 | 0 | 113.8 | A14 R15 S21 | A14-F18 PolarHBondContact O-N 2.8Å; R15-F18 PolarHBondContact O-N 3.21Å; F18-S21 WeakPolarHBondContact CA-OG 3.42Å; F18-S21 PolarHBondContact O-N 3.22Å; F18-S21 PolarHBondContact O-OG 3.02Å |
| 19 | R | 49 | Very low | 52.8 | Low | 203 Ų | 203 | 132.7 Ų | 132.7 | 77% | 0.766 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -72.5 | -30.1 | 172.8 | -111.7 | -177.6 | 163.6 | -179.6 | -4.5 | 112.8 | R15 S21 | R15-R19 WeakPolarHBondContact O-CB 3.41Å; R15-R19 PolarHBondContact O-N 3.21Å; R19-S21 VanDerWaalsContact C-N 3.3Å |
| 20 | G | 43.9 | Very low | 51.6 | Low | 55 Ų | 55 | 129.6 Ų | 129.6 | 57% | 0.567 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -69.2 | -25 | 173.6 | 0 | 0 | 0 | 0 | 0 | 114 | L16 R17 | L16-G20 PolarHBondContact O-N 2.85Å; L16-G20 VanDerWaalsContact O-N 3.17Å; R17-G20 PolarHBondContact O-N 3.44Å |
| 21 | S | 46.5 | Very low | 50 | Low | 84 Ų | 84 | 132.5 Ų | 132.5 | 59% | 0.587 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.8 | -2.3 | 178.8 | 51.8 | 0 | 0 | 0 | 0 | 115 | R17 F18 R19 | R17-S21 PolarHBondContact O-N 3.38Å; R17-S21 PolarHBondContact O-OG 3.18Å; F18-S21 WeakPolarHBondContact CA-OG 3.42Å; F18-S21 PolarHBondContact O-N 3.22Å; F18-S21 PolarHBondContact O-OG 3.02Å; R19-S21 VanDerWaalsContact C-N 3.3Å |
| 22 | L | 43.5 | Very low | 48.5 | Very low | 135 Ų | 135 | 134.3 Ų | 134.3 | 71% | 0.707 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -107.5 | 4.9 | -179.1 | -73.1 | 168.9 | 0 | 0 | 0 | 113.9 | ||
| 23 | L | 42.4 | Very low | 46.9 | Very low | 140 Ų | 140 | 132.5 Ų | 132.5 | 73% | 0.733 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -88.4 | 118 | 171.1 | -83 | 154.4 | 0 | 0 | 0 | 109.1 | ||
| 24 | P | 43.1 | Very low | 45.5 | Very low | 102 Ų | 102 | 140.6 Ų | 140.6 | 66% | 0.662 | 74% | 0.741 | S | S | * | * | trans | -64.3 | 150.6 | 177.4 | 26.7 | -32.4 | 0 | 0 | 0 | 110.4 | Q26 | P24-Q26 PolarHBondContact O-N 3.1Å; P24-Q26 VanDerWaalsContact O-N 3.08Å | ||
| 25 | P | 41.6 | Very low | 44.1 | Very low | 127 Ų | 127 | 142.1 Ų | 142.1 | 83% | 0.825 | 76% | 0.762 | S | S | * | * | trans | -64 | 113.9 | 178.2 | 26 | -32.1 | 0 | 0 | 0 | 109.6 | R27 | P25-R27 PolarHBondContact O-N 3.41Š| ||
| 26 | Q | 40 | Very low | 42.9 | Very low | 186 Ų | 186 | 139.8 Ų | 139.8 | 87% | 0.869 | 77% | 0.769 | S | S | * | * | trans | -63.7 | 102.4 | 168.5 | -79 | -87.3 | -27.7 | 0 | 0 | 108.2 | P24 | P24-Q26 PolarHBondContact O-N 3.1Å; P24-Q26 VanDerWaalsContact O-N 3.08Å | ||
| 27 | R | 40.4 | Very low | 41.9 | Very low | 227 Ų | 227 | 143.5 Ų | 143.5 | 86% | 0.857 | 78% | 0.78 | S | S | * | * | trans | -59.8 | 133.7 | 166.5 | -92.4 | -178 | 174.1 | 169.8 | -1.7 | 109.1 | P25 R29 | P25-R27 PolarHBondContact O-N 3.41Å; R27-R29 PolarHBondContact O-N 2.89Å | ||
| 28 | P | 40.8 | Very low | 41.1 | Very low | 127 Ų | 127 | 138 Ų | 138 | 83% | 0.825 | 78% | 0.78 | S | S | * | * | trans | -72.2 | 112.1 | 167.3 | 28.5 | -28.6 | 0 | 0 | 0 | 108.3 | S30 | P28-S30 PolarHBondContact O-N 2.92Š| ||
| 29 | R | 37.7 | Very low | 40.8 | Very low | 242 Ų | 242 | 136.6 Ų | 136.6 | 91% | 0.913 | 79% | 0.786 | S | S | * | * | trans | -78.8 | 110.7 | 173.3 | -166.4 | 174.7 | -179.6 | 107.8 | -1.8 | 108 | R27 | R27-R29 PolarHBondContact O-N 2.89Š| ||
| 30 | S | 44.3 | Very low | 40.7 | Very low | 119 Ų | 119 | 130.4 Ų | 130.4 | 83% | 0.832 | 79% | 0.786 | S | S | * | * | trans | -68.3 | 133.2 | 164.5 | 55.1 | 0 | 0 | 0 | 0 | 109.5 | P28 | P28-S30 PolarHBondContact O-N 2.92Š| ||
| 31 | G | 35.3 | Very low | 40.6 | Very low | 78 Ų | 78 | 136.9 Ų | 136.9 | 80% | 0.804 | 80% | 0.801 | S | S | * | * | trans | 176.7 | 103.2 | 176 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 32 | G | 36.2 | Very low | 40.5 | Very low | 74 Ų | 74 | 135.9 Ų | 135.9 | 76% | 0.763 | 80% | 0.804 | S | S | * | * | trans | -91.5 | 179.7 | -165.2 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 33 | S | 36.8 | Very low | 40.6 | Very low | 119 Ų | 119 | 135.2 Ų | 135.2 | 83% | 0.832 | 81% | 0.807 | S | S | * | * | trans | 83.7 | 102.4 | 160.6 | 76.2 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 34 | R | 38.4 | Very low | 40.8 | Very low | 248 Ų | 248 | 140.4 Ų | 140.4 | 94% | 0.936 | 82% | 0.817 | S | S | * | * | 174.1 | 125.7 | 102.1 | -101.4 | 179.5 | 173.2 | 167.6 | -1 | 112.9 | |||||
| 35 | G | 34.1 | Very low | 41 | Very low | 82 Ų | 82 | 141.8 Ų | 141.8 | 85% | 0.845 | 82% | 0.823 | S | S | * | * | trans | 79.1 | 146.5 | 161.3 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 36 | S | 35.9 | Very low | 41.2 | Very low | 106 Ų | 106 | 138.9 Ų | 138.9 | 74% | 0.741 | 82% | 0.817 | S | S | * | * | cis | -175.2 | 126.9 | 3.4 | 175.2 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 37 | F | 38.8 | Very low | 41.3 | Very low | 196 Ų | 196 | 134.8 Ų | 134.8 | 86% | 0.86 | 81% | 0.814 | S | S | * | * | trans | 41.4 | 108.7 | 157.5 | -63.1 | -80.9 | 0 | 0 | 0 | 124 | ||||
| 38 | A | 42.8 | Very low | 41.6 | Very low | 95 Ų | 95 | 128.7 Ų | 128.7 | 79% | 0.785 | 81% | 0.807 | S | S | * | * | 65.7 | 163.7 | 128.1 | 0 | 0 | 0 | 0 | 0 | 122.6 | |||||
| 39 | P | 46.2 | Very low | 42.4 | Very low | 123 Ų | 123 | 127.7 Ų | 127.7 | 80% | 0.799 | 80% | 0.8 | S | S | * | * | cis | -125.3 | 154.2 | -30 | 32.4 | -14.2 | 0 | 0 | 0 | 114 | ||||
| 40 | G | 45.2 | Very low | 43.5 | Very low | 74 Ų | 74 | 121.6 Ų | 121.6 | 76% | 0.763 | 79% | 0.792 | S | S | * | * | trans | 49.4 | 102 | 151.5 | 0 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 41 | H | 43.8 | Very low | 44.7 | Very low | 191 Ų | 191 | 121.9 Ų | 121.9 | 88% | 0.884 | 79% | 0.791 | S | S | * | * | trans | -131.7 | 128.6 | 147.8 | -94.3 | 46.5 | 0 | 0 | 0 | 108.1 | ||||
| 42 | G | 44.3 | Very low | 46.5 | Very low | 62 Ų | 62 | 122.2 Ų | 122.2 | 64% | 0.639 | 78% | 0.777 | S | S | * | * | trans | -63.9 | -175.1 | -167.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | R44 | G42-R44 PolarHBondContact O-N 2.92Š| ||
| 43 | P | 44.5 | Very low | 48.7 | Very low | 121 Ų | 121 | 121 Ų | 121 | 79% | 0.786 | 76% | 0.757 | S | S | * | * | trans | -54.8 | 128.3 | 179.5 | -10.8 | 21.8 | 0 | 0 | 0 | 108.5 | V45 | P43-V45 PolarHBondContact O-N 3.34Š| ||
| 44 | R | 46.4 | Very low | 50.9 | Low | 250 Ų | 250 | 122.1 Ų | 122.1 | 94% | 0.943 | 75% | 0.749 | S | S | * | * | trans | -61 | 88.7 | 165.7 | -73.7 | -177.9 | 175.8 | 133.8 | -1.3 | 106.9 | G42 G46 | G42-R44 PolarHBondContact O-N 2.92Å; R44-G46 PolarHBondContact O-N 3.48Å; R44-G46 VanDerWaalsContact O-N 3.13Å | ||
| 45 | V | 47.3 | Very low | 53 | Low | 130 Ų | 130 | 116.7 Ų | 116.7 | 79% | 0.788 | 74% | 0.738 | S | S | * | * | trans | -48.3 | 119.9 | 164 | 174.9 | 0 | 0 | 0 | 0 | 105 | P43 A47 | P43-V45 PolarHBondContact O-N 3.34Å; V45-A47 PolarHBondContact O-N 3.26Å | ||
| 46 | G | 45.4 | Very low | 55.3 | Low | 67 Ų | 67 | 116.9 Ų | 116.9 | 69% | 0.691 | 72% | 0.72 | S | S | * | * | trans | -48.4 | 114.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 108.1 | R44 S48 | R44-G46 PolarHBondContact O-N 3.48Å; R44-G46 VanDerWaalsContact O-N 3.13Å; G46-S48 VanDerWaalsContact C-N 3.27Å; G46-S48 PolarHBondContact O-N 2.8Å | ||
| 47 | A | 43.8 | Very low | 57.5 | Low | 99 Ų | 99 | 119.2 Ų | 119.2 | 82% | 0.818 | 71% | 0.712 | S | S | * | * | trans | -59.9 | 100.6 | 172.8 | 0 | 0 | 0 | 0 | 0 | 106 | V45 | V45-A47 PolarHBondContact O-N 3.26Š| ||
| 48 | S | 46.8 | Very low | 59.7 | Low | 100 Ų | 100 | 112.1 Ų | 112.1 | 70% | 0.699 | 69% | 0.69 | S | S | * | * | P | Polyproline II helix | trans | -50.2 | 133.7 | 165.7 | -175.6 | 0 | 0 | 0 | 0 | 106.3 | G46 | G46-S48 VanDerWaalsContact C-N 3.27Å; G46-S48 PolarHBondContact O-N 2.8Å |
| 49 | P | 57.1 | Low | 61.8 | Low | 105 Ų | 105 | 112.6 Ų | 112.6 | 68% | 0.682 | 68% | 0.679 | S | S | * | * | P | Polyproline II helix | trans | -51.7 | 139.6 | 174.7 | 21.6 | -31.2 | 0 | 0 | 0 | 108.6 | ||
| 50 | P | 59.6 | Low | 63.5 | Low | 114 Ų | 114 | 107 Ų | 107 | 74% | 0.74 | 64% | 0.643 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 136.5 | -177.6 | 22.2 | -32.6 | 0 | 0 | 0 | 109.2 | V52 | P50-V52 PolarHBondContact O-N 2.64Š|
| 51 | P | 69.6 | Low | 65.3 | Low | 125 Ų | 125 | 110.5 Ų | 110.5 | 81% | 0.812 | 63% | 0.633 | S | S | * | * | P | Polyproline II helix | trans | -59 | 126.3 | 178.4 | 24.2 | -32.1 | 0 | 0 | 0 | 108.8 | S53 | P51-S53 PolarHBondContact O-N 3.28Š|
| 52 | V | 72.6 | Confident | 67.4 | Low | 85 Ų | 85 | 106.1 Ų | 106.1 | 52% | 0.515 | 62% | 0.616 | S | S | . | * | P | Polyproline II helix | trans | -55.3 | 127.1 | 177.7 | 177.5 | 0 | 0 | 0 | 0 | 108.7 | P50 D56 | P50-V52 PolarHBondContact O-N 2.64Å; V52-D56 HydrophobicContact CG1-CB 3.95Å |
| 53 | S | 82.5 | Confident | 69.3 | Low | 49 Ų | 49 | 105.5 Ų | 105.5 | 34% | 0.343 | 60% | 0.598 | S | S | . | * | P | Polyproline II helix | trans | -73.8 | 151.1 | 179.6 | 76.2 | 0 | 0 | 0 | 0 | 111.3 | P51 L55 D56 R57 | P51-S53 PolarHBondContact O-N 3.28Å; S53-L55 PolarHBondContact O-N 3.03Å; S53-D56 WeakPolarHBondContact CB-OD2 3.5Å; S53-D56 PolarHBondContact N-OD2 2.82Å; S53-D56 WeakPolarHBondContact O-CB 3.43Å; S53-D56 PolarHBondContact O-N 3.09Å; S53-D56 PolarHBondContact OG-N 3.25Å; S53-D56 VanDerWaalsContact OG-N 3.13Å; S53-D56 PolarHBondContact OG-OD2 3.1Å; S53-R57 PolarHBondContact O-N 3.33Å |
| 54 | E | 83.6 | Confident | 71.1 | Confident | 142 Ų | 142 | 103.4 Ų | 103.4 | 66% | 0.664 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -57.4 | -29.9 | 174.1 | -73.4 | -65.2 | 138.1 | 0 | 0 | 112 | R57 A58 | E54-R57 WeakPolarHBondContact O-CB 3.3Å; E54-R57 PolarHBondContact O-N 3.35Å; E54-A58 WeakPolarHBondContact O-CB 3.28Å; E54-A58 PolarHBondContact O-N 3.07Å |
| 55 | L | 81.8 | Confident | 73 | Confident | 134 Ų | 134 | 95.3 Ų | 95.3 | 70% | 0.702 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -66.6 | -44.2 | 173.9 | -176.6 | 63 | 0 | 0 | 0 | 111.8 | S53 R57 A58 D59 | S53-L55 PolarHBondContact O-N 3.03Å; L55-R57 PolarHBondContact O-N 3.16Å; L55-A58 PolarHBondContact O-N 3.26Å; L55-D59 PolarHBondContact O-N 3.5Å |
| 56 | D | 82.5 | Confident | 74.9 | Confident | 86 Ų | 86 | 91.8 Ų | 91.8 | 46% | 0.46 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -63.8 | -34.1 | 175.8 | -61.5 | -44.5 | 0 | 0 | 0 | 111.2 | V52 S53 A60 | V52-D56 HydrophobicContact CG1-CB 3.95Å; S53-D56 WeakPolarHBondContact CB-OD2 3.5Å; S53-D56 PolarHBondContact N-OD2 2.82Å; S53-D56 WeakPolarHBondContact O-CB 3.43Å; S53-D56 PolarHBondContact O-N 3.09Å; S53-D56 PolarHBondContact OG-N 3.25Å; S53-D56 VanDerWaalsContact OG-N 3.13Å; S53-D56 PolarHBondContact OG-OD2 3.1Å; D56-A60 VanDerWaalsContact O-CB 3.27Å; D56-A60 WeakPolarHBondContact O-CB 3.39Å; D56-A60 PolarHBondContact O-N 2.94Å |
| 57 | R | 82.4 | Confident | 76.8 | Confident | 156 Ų | 156 | 89.4 Ų | 89.4 | 59% | 0.589 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -68.5 | -41.7 | 175.3 | -163.6 | 178.3 | -166.6 | 172.3 | 3.3 | 111.7 | S53 E54 L55 W61 | S53-R57 PolarHBondContact O-N 3.33Å; E54-R57 WeakPolarHBondContact O-CB 3.3Å; E54-R57 PolarHBondContact O-N 3.35Å; L55-R57 PolarHBondContact O-N 3.16Å; R57-W61 WeakPolarHBondContact O-CB 3.31Å; R57-W61 PolarHBondContact O-N 3.44Å |
| 58 | A | 85.7 | Confident | 78.8 | Confident | 46 Ų | 46 | 87.3 Ų | 87.3 | 38% | 0.38 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -64.2 | -42.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | E54 L55 W61 L62 | E54-A58 WeakPolarHBondContact O-CB 3.28Å; E54-A58 PolarHBondContact O-N 3.07Å; L55-A58 PolarHBondContact O-N 3.26Å; A58-W61 PolarHBondContact O-N 3.31Å; A58-L62 WeakPolarHBondContact O-CG 3.43Å; A58-L62 PolarHBondContact O-N 3.33Å |
| 59 | D | 85.9 | Confident | 80.8 | Confident | 105 Ų | 105 | 86.7 Ų | 86.7 | 56% | 0.561 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -64.7 | -44.3 | 176.8 | -170.3 | 55 | 0 | 0 | 0 | 111.8 | L55 W61 L62 L63 | L55-D59 PolarHBondContact O-N 3.5Å; D59-W61 VanDerWaalsContact C-N 3.27Å; D59-W61 PolarHBondContact O-N 3.13Å; D59-L62 PolarHBondContact O-N 3.44Å; D59-L63 VanDerWaalsContact O-CB 3.29Å; D59-L63 WeakPolarHBondContact O-CB 3.39Å; D59-L63 PolarHBondContact O-N 2.72Å |
| 60 | A | 82.4 | Confident | 82.3 | Confident | 5 Ų | 5 | 84 Ų | 84 | 4% | 0.041 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -59.6 | -38.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | D56 R64 P127 | D56-A60 VanDerWaalsContact O-CB 3.27Å; D56-A60 WeakPolarHBondContact O-CB 3.39Å; D56-A60 PolarHBondContact O-N 2.94Å; A60-R64 PolarHBondContact O-N 3.49Å; A60-R64 VanDerWaalsContact O-N 3.12Å; A60-P127 VanDerWaalsContact CB-O 3.29Å; A60-P127 WeakPolarHBondContact CB-O 3.4Å |
| 61 | W | 83.8 | Confident | 83.7 | Confident | 148 Ų | 148 | 79.6 Ų | 79.6 | 56% | 0.561 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -69.2 | -45.3 | 175.8 | -176.4 | 92.7 | 0 | 0 | 0 | 112 | R57 A58 D59 L63 R64 K65 | R57-W61 WeakPolarHBondContact O-CB 3.31Å; R57-W61 PolarHBondContact O-N 3.44Å; A58-W61 PolarHBondContact O-N 3.31Å; D59-W61 VanDerWaalsContact C-N 3.27Å; D59-W61 PolarHBondContact O-N 3.13Å; W61-L63 VanDerWaalsContact C-N 3.33Å; W61-L63 PolarHBondContact O-N 2.92Å; W61-R64 WeakPolarHBondContact O-CB 3.26Å; W61-R64 PolarHBondContact O-N 2.9Å; W61-K65 HydrophobicContact CD2-CG 4.03Å; W61-K65 HydrophobicContact CE3-CG 4.14Å; W61-K65 HydrophobicContact CH2-CD 4.5Å; W61-K65 HydrophobicContact CH2-CG 3.85Å; W61-K65 HydrophobicContact CZ2-CD 4.14Å; W61-K65 HydrophobicContact CZ2-CG 3.72Å; W61-K65 HydrophobicContact CZ3-CG 4.05Å; W61-K65 PolarHBondContact O-N 2.89Å |
| 62 | L | 87.3 | Confident | 84.6 | Confident | 99 Ų | 99 | 78.3 Ų | 78.3 | 52% | 0.518 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -60.9 | -43.5 | 176.7 | -74.9 | 172.2 | 0 | 0 | 0 | 111.4 | A58 D59 R64 K65 A66 | A58-L62 WeakPolarHBondContact O-CG 3.43Å; A58-L62 PolarHBondContact O-N 3.33Å; D59-L62 PolarHBondContact O-N 3.44Å; L62-R64 VanDerWaalsContact C-N 3.29Å; L62-R64 PolarHBondContact O-N 3.4Å; L62-K65 PolarHBondContact O-N 3.17Å; L62-A66 WeakPolarHBondContact O-CB 3.16Å; L62-A66 PolarHBondContact O-N 3.32Å |
| 63 | L | 83.3 | Confident | 85.5 | Confident | 50 Ų | 50 | 76.5 Ų | 76.5 | 26% | 0.262 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -60.5 | -40.4 | 176.5 | -172.9 | 64.9 | 0 | 0 | 0 | 111.4 | D59 W61 H67 L124 P127 M128 | D59-L63 VanDerWaalsContact O-CB 3.29Å; D59-L63 WeakPolarHBondContact O-CB 3.39Å; D59-L63 PolarHBondContact O-N 2.72Å; W61-L63 VanDerWaalsContact C-N 3.33Å; W61-L63 PolarHBondContact O-N 2.92Å; L63-H67 WeakPolarHBondContact O-CB 3.5Å; L63-H67 PolarHBondContact O-N 3.32Å; L63-L124 HydrophobicContact CD1-CD1 4.44Å; L63-L124 HydrophobicContact CD1-CD2 4.45Å; L63-L124 HydrophobicContact CD2-CB 4.44Å; L63-L124 HydrophobicContact CD2-CD2 4.06Å; L63-P127 HydrophobicContact CD2-CB 3.77Å; L63-M128 HydrophobicContact CB-CG 4.21Å; L63-M128 HydrophobicContact CD2-CG 3.63Å; L63-M128 HydrophobicContact CD2-SD 4.48Å; L63-M128 HydrophobicContact CG-CG 3.84Å; L63-M128 HydrophobicContact CG-SD 4.29Å |
| 64 | R | 82.6 | Confident | 85.9 | Confident | 76 Ų | 76 | 79.8 Ų | 79.8 | 29% | 0.287 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -63.4 | -46.3 | 174.9 | -171.1 | 175.8 | -58.1 | 175.2 | -0.1 | 112.1 | A60 W61 L62 H67 E68 M128 L130 | A60-R64 PolarHBondContact O-N 3.49Å; A60-R64 VanDerWaalsContact O-N 3.12Å; W61-R64 WeakPolarHBondContact O-CB 3.26Å; W61-R64 PolarHBondContact O-N 2.9Å; L62-R64 VanDerWaalsContact C-N 3.29Å; L62-R64 PolarHBondContact O-N 3.4Å; R64-H67 PolarHBondContact O-N 2.89Å; R64-E68 WeakPolarHBondContact CG-OE1 3.18Å; R64-E68 WeakPolarHBondContact O-CG 3.48Å; R64-E68 PolarHBondContact O-N 3.37Å; R64-M128 VanDerWaalsContact CA-CE 3.42Å; R64-M128 HydrophobicContact CB-CE 3.55Å; R64-M128 HydrophobicContact CG-CE 3.51Å; R64-M128 PolarHBondContact NH2-O 3.12Å; R64-L130 HydrophobicContact CG-CD1 4.4Å; R64-L130 VanDerWaalsContact NE-CD1 3.32Å |
| 65 | K | 86.3 | Confident | 86.2 | Confident | 81 Ų | 81 | 74.6 Ų | 74.6 | 35% | 0.352 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -68 | -39.6 | -179.9 | -71.2 | -70.6 | 162.1 | -155.8 | 0 | 112.6 | W61 L62 H67 E68 T69 | W61-K65 HydrophobicContact CD2-CG 4.03Å; W61-K65 HydrophobicContact CE3-CG 4.14Å; W61-K65 HydrophobicContact CH2-CD 4.5Å; W61-K65 HydrophobicContact CH2-CG 3.85Å; W61-K65 HydrophobicContact CZ2-CD 4.14Å; W61-K65 HydrophobicContact CZ2-CG 3.72Å; W61-K65 HydrophobicContact CZ3-CG 4.05Å; W61-K65 PolarHBondContact O-N 2.89Å; L62-K65 PolarHBondContact O-N 3.17Å; K65-H67 VanDerWaalsContact C-N 3.28Å; K65-H67 PolarHBondContact O-N 3.38Å; K65-E68 IonicContact NZ-OE2 2.79Å; K65-E68 PolarHBondContact NZ-OE2 3.05Å; K65-E68 PolarHBondContact O-N 3.29Å; K65-T69 WeakPolarHBondContact O-CB 3.47Å; K65-T69 VanDerWaalsContact O-CG2 3.27Å; K65-T69 WeakPolarHBondContact O-CG2 3.33Å; K65-T69 PolarHBondContact O-N 3.13Å; K65-T69 PolarHBondContact O-OG1 3.19Å |
| 66 | A | 87.4 | Confident | 86.7 | Confident | 56 Ų | 56 | 75.3 Ų | 75.3 | 46% | 0.463 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -61.2 | -39 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | L62 T69 A70 | L62-A66 WeakPolarHBondContact O-CB 3.16Å; L62-A66 PolarHBondContact O-N 3.32Å; A66-T69 PolarHBondContact O-OG1 3.49Å; A66-T69 VanDerWaalsContact O-OG1 3.12Å; A66-A70 VanDerWaalsContact O-CB 3.3Å; A66-A70 WeakPolarHBondContact O-CB 3.49Å; A66-A70 PolarHBondContact O-N 3.32Å |
| 67 | H | 85.4 | Confident | 87.2 | Confident | 16 Ų | 16 | 74.3 Ų | 74.3 | 7% | 0.074 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -68.9 | -41.7 | 178.4 | -158.8 | 58.1 | 0 | 0 | 0 | 112.4 | L63 R64 K65 F71 Y117 | L63-H67 WeakPolarHBondContact O-CB 3.5Å; L63-H67 PolarHBondContact O-N 3.32Å; R64-H67 PolarHBondContact O-N 2.89Å; K65-H67 VanDerWaalsContact C-N 3.28Å; K65-H67 PolarHBondContact O-N 3.38Å; H67-F71 PolarHBondContact O-N 2.93Å; H67-Y117 AromaticContact CD2-CD2 3.43Å; H67-Y117 VanDerWaalsContact CD2-CD2 3.43Å; H67-Y117 WeakPolarHBondContact CD2-CD2 3.47Å; H67-Y117 AromaticContact CD2-CE2 3.6Å; H67-Y117 WeakPolarHBondContact NE2-CA 3.29Å; H67-Y117 AromaticContact NE2-CD2 3.5Å; H67-Y117 PolarHBondContact NE2-O 3.38Å |
| 68 | E | 86.9 | Confident | 87.6 | Confident | 56 Ų | 56 | 66.9 Ų | 66.9 | 26% | 0.262 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -64 | -47.3 | 174.3 | -73.2 | 169.4 | -168.9 | 0 | 0 | 112.1 | R64 K65 A70 F71 L72 | R64-E68 WeakPolarHBondContact CG-OE1 3.18Å; R64-E68 WeakPolarHBondContact O-CG 3.48Å; R64-E68 PolarHBondContact O-N 3.37Å; K65-E68 IonicContact NZ-OE2 2.79Å; K65-E68 PolarHBondContact NZ-OE2 3.05Å; K65-E68 PolarHBondContact O-N 3.29Å; E68-A70 VanDerWaalsContact C-N 3.35Å; E68-A70 PolarHBondContact O-N 2.82Å; E68-F71 PolarHBondContact O-N 2.87Å; E68-L72 WeakPolarHBondContact O-CB 3.27Å; E68-L72 VanDerWaalsContact O-CG 3.3Å; E68-L72 WeakPolarHBondContact O-CG 3.36Å; E68-L72 PolarHBondContact O-N 2.72Å |
| 69 | T | 88.8 | Confident | 87.9 | Confident | 86 Ų | 86 | 68.4 Ų | 68.4 | 53% | 0.528 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -67.2 | -36.2 | -178.3 | 55.5 | 0 | 0 | 0 | 0 | 112.3 | K65 A66 S73 | K65-T69 WeakPolarHBondContact O-CB 3.47Å; K65-T69 VanDerWaalsContact O-CG2 3.27Å; K65-T69 WeakPolarHBondContact O-CG2 3.33Å; K65-T69 PolarHBondContact O-N 3.13Å; K65-T69 PolarHBondContact O-OG1 3.19Å; A66-T69 PolarHBondContact O-OG1 3.49Å; A66-T69 VanDerWaalsContact O-OG1 3.12Å; T69-S73 WeakPolarHBondContact O-CB 3.41Å; T69-S73 PolarHBondContact O-N 3.04Å |
| 70 | A | 88.4 | Confident | 88.3 | Confident | 48 Ų | 48 | 68.3 Ų | 68.3 | 40% | 0.397 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -60.9 | -50.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | A66 E68 L72 S73 W74 | A66-A70 VanDerWaalsContact O-CB 3.3Å; A66-A70 WeakPolarHBondContact O-CB 3.49Å; A66-A70 PolarHBondContact O-N 3.32Å; E68-A70 VanDerWaalsContact C-N 3.35Å; E68-A70 PolarHBondContact O-N 2.82Å; A70-L72 PolarHBondContact O-N 3.32Å; A70-S73 WeakPolarHBondContact O-CB 3.47Å; A70-S73 PolarHBondContact O-N 2.91Å; A70-W74 PolarHBondContact O-N 2.98Å |
| 71 | F | 88.4 | Confident | 88.8 | Confident | 22 Ų | 22 | 68.6 Ų | 68.6 | 10% | 0.096 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -58.1 | -49.4 | 176.9 | 166.8 | -106.3 | 0 | 0 | 0 | 112.1 | H67 E68 S73 W74 F75 Y117 V142 | H67-F71 PolarHBondContact O-N 2.93Å; E68-F71 PolarHBondContact O-N 2.87Å; F71-S73 PolarHBondContact O-N 3.08Å; F71-W74 PolarHBondContact O-N 3.17Å; F71-W74 VanDerWaalsContact O-N 3.16Å; F71-F75 HydrophobicContact CE1-CB 4.44Å; F71-F75 HydrophobicContact CE2-CB 4.3Å; F71-F75 HydrophobicContact CZ-CB 4.1Å; F71-F75 HydrophobicContact CZ-CD2 4.13Å; F71-F75 HydrophobicContact CZ-CG 4.17Å; F71-F75 WeakPolarHBondContact O-CB 3.44Å; F71-F75 PolarHBondContact O-N 2.83Å; F71-Y117 HydrophobicContact CB-CD2 3.64Å; F71-Y117 HydrophobicContact CB-CE2 4.37Å; F71-Y117 HydrophobicContact CB-CG 4.08Å; F71-Y117 HydrophobicContact CD2-CG 4.15Å; F71-Y117 AromaticContact CG-CD2 3.99Å; F71-Y117 HydrophobicContact CG-CD2 3.99Å; F71-Y117 HydrophobicContact CG-CG 4.03Å; F71-V142 HydrophobicContact CD1-CG2 4.39Å; F71-V142 HydrophobicContact CD2-CG2 4.44Å; F71-V142 HydrophobicContact CE1-CG2 3.78Å; F71-V142 HydrophobicContact CE2-CB 4.47Å; F71-V142 HydrophobicContact CE2-CG1 3.83Å; F71-V142 HydrophobicContact CE2-CG2 3.84Å; F71-V142 HydrophobicContact CZ-CB 4.24Å; F71-V142 HydrophobicContact CZ-CG1 3.99Å; F71-V142 HydrophobicContact CZ-CG2 3.48Å; F71-V142 VanDerWaalsContact CZ-CG2 3.48Å |
| 72 | L | 89.2 | Confident | 89.1 | Confident | 99 Ų | 99 | 62 Ų | 62 | 52% | 0.518 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -61.6 | -33.5 | -179 | -71.5 | 172.4 | 0 | 0 | 0 | 112.4 | E68 A70 R76 | E68-L72 WeakPolarHBondContact O-CB 3.27Å; E68-L72 VanDerWaalsContact O-CG 3.3Å; E68-L72 WeakPolarHBondContact O-CG 3.36Å; E68-L72 PolarHBondContact O-N 2.72Å; A70-L72 PolarHBondContact O-N 3.32Å; L72-R76 WeakPolarHBondContact O-CB 3.39Å; L72-R76 PolarHBondContact O-N 2.99Å |
| 73 | S | 91 | Very high | 89.2 | Confident | 47 Ų | 47 | 58.8 Ų | 58.8 | 33% | 0.329 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -64.4 | -48.7 | 174.5 | -174.2 | 0 | 0 | 0 | 0 | 111.7 | T69 A70 F71 F75 R76 N77 | T69-S73 WeakPolarHBondContact O-CB 3.41Å; T69-S73 PolarHBondContact O-N 3.04Å; A70-S73 WeakPolarHBondContact O-CB 3.47Å; A70-S73 PolarHBondContact O-N 2.91Å; F71-S73 PolarHBondContact O-N 3.08Å; S73-F75 PolarHBondContact O-N 2.89Å; S73-R76 PolarHBondContact O-N 3.34Å; S73-N77 WeakPolarHBondContact O-CB 2.99Å; S73-N77 PolarHBondContact O-N 3.05Å; S73-N77 PolarHBondContact O-ND2 3.41Å; S73-N77 PolarHBondContact O-OD1 2.82Å |
| 74 | W | 90.7 | Very high | 89.6 | Confident | 117 Ų | 117 | 60.1 Ų | 60.1 | 44% | 0.443 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -60 | -45.9 | 175.2 | -73.9 | 108 | 0 | 0 | 0 | 111.7 | A70 F71 N77 G78 C109 | A70-W74 PolarHBondContact O-N 2.98Å; F71-W74 PolarHBondContact O-N 3.17Å; F71-W74 VanDerWaalsContact O-N 3.16Å; W74-N77 PolarHBondContact O-N 3.44Å; W74-G78 PolarHBondContact O-N 3.36Å; W74-C109 WeakPolarHBondContact O-CB 3.45Å |
| 75 | F | 90 | Very high | 89.9 | Confident | 33 Ų | 33 | 56.5 Ų | 56.5 | 15% | 0.145 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -64.2 | -47 | -179.7 | -171.1 | -104.1 | 0 | 0 | 0 | 111.9 | F71 S73 N77 G78 L79 V110 A145 | F71-F75 HydrophobicContact CE1-CB 4.44Å; F71-F75 HydrophobicContact CE2-CB 4.3Å; F71-F75 HydrophobicContact CZ-CB 4.1Å; F71-F75 HydrophobicContact CZ-CD2 4.13Å; F71-F75 HydrophobicContact CZ-CG 4.17Å; F71-F75 WeakPolarHBondContact O-CB 3.44Å; F71-F75 PolarHBondContact O-N 2.83Å; S73-F75 PolarHBondContact O-N 2.89Å; F75-N77 VanDerWaalsContact C-N 3.34Å; F75-N77 PolarHBondContact O-N 2.69Å; F75-G78 WeakPolarHBondContact O-CA 3.48Å; F75-G78 PolarHBondContact O-N 2.87Å; F75-G78 VanDerWaalsContact O-N 3.12Å; F75-L79 HydrophobicContact CD1-CD1 3.91Å; F75-L79 HydrophobicContact CD1-CG 4.2Å; F75-L79 HydrophobicContact CE1-CD1 3.48Å; F75-L79 VanDerWaalsContact CE1-CD1 3.48Å; F75-L79 HydrophobicContact CE1-CD2 4.29Å; F75-L79 HydrophobicContact CE1-CG 3.91Å; F75-L79 HydrophobicContact CZ-CD1 4.14Å; F75-L79 HydrophobicContact CZ-CD2 4.12Å; F75-L79 HydrophobicContact CZ-CG 4.21Å; F75-L79 WeakPolarHBondContact O-CG 3.3Å; F75-L79 PolarHBondContact O-N 3.28Å; F75-V110 HydrophobicContact CD2-CG1 4.21Å; F75-V110 HydrophobicContact CD2-CG2 4.01Å; F75-V110 HydrophobicContact CE2-CG1 4.03Å; F75-V110 HydrophobicContact CE2-CG2 4.08Å; F75-A145 HydrophobicContact CE2-CB 4.11Å; F75-A145 HydrophobicContact CZ-CB 3.89Å |
| 76 | R | 92.3 | Very high | 89.9 | Confident | 149 Ų | 149 | 55.1 Ų | 55.1 | 56% | 0.562 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -58.3 | -45.4 | 175.4 | -177.5 | -171.1 | 68.2 | -166.9 | -0.6 | 111.5 | L72 S73 G78 L79 L80 | L72-R76 WeakPolarHBondContact O-CB 3.39Å; L72-R76 PolarHBondContact O-N 2.99Å; S73-R76 PolarHBondContact O-N 3.34Å; R76-G78 VanDerWaalsContact C-N 3.27Å; R76-G78 PolarHBondContact O-N 2.92Å; R76-L79 PolarHBondContact O-N 2.95Å; R76-L80 HydrophobicContact CG-CD1 4.16Å; R76-L80 HydrophobicContact CG-CG 4.44Å; R76-L80 WeakPolarHBondContact O-CB 3.39Å; R76-L80 VanDerWaalsContact O-CG 3.31Å; R76-L80 WeakPolarHBondContact O-CG 3.22Å; R76-L80 PolarHBondContact O-N 3.49Å |
| 77 | N | 93 | Very high | 89.8 | Confident | 65 Ų | 65 | 57.1 Ų | 57.1 | 35% | 0.348 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -64.6 | -36.2 | 178.5 | -63.7 | -12.4 | 0 | 0 | 0 | 111.1 | S73 W74 F75 L80 A81 | S73-N77 WeakPolarHBondContact O-CB 2.99Å; S73-N77 PolarHBondContact O-N 3.05Å; S73-N77 PolarHBondContact O-ND2 3.41Å; S73-N77 PolarHBondContact O-OD1 2.82Å; W74-N77 PolarHBondContact O-N 3.44Å; F75-N77 VanDerWaalsContact C-N 3.34Å; F75-N77 PolarHBondContact O-N 2.69Å; N77-L80 PolarHBondContact O-N 2.84Å; N77-A81 WeakPolarHBondContact O-CB 3.25Å; N77-A81 PolarHBondContact O-N 3.26Å |
| 78 | G | 91.2 | Very high | 89.8 | Confident | 0 Ų | 0 | 57.4 Ų | 57.4 | 0% | 0 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -64.1 | -43.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | W74 F75 R76 A81 S82 G106 | W74-G78 PolarHBondContact O-N 3.36Å; F75-G78 WeakPolarHBondContact O-CA 3.48Å; F75-G78 PolarHBondContact O-N 2.87Å; F75-G78 VanDerWaalsContact O-N 3.12Å; R76-G78 VanDerWaalsContact C-N 3.27Å; R76-G78 PolarHBondContact O-N 2.92Å; G78-A81 PolarHBondContact O-N 3.05Å; G78-S82 WeakPolarHBondContact O-CB 3.32Å; G78-S82 PolarHBondContact O-N 3.27Å; G78-S82 PolarHBondContact O-OG 3.4Å; G78-G106 WeakPolarHBondContact O-CA 3.4Å |
| 79 | L | 92.4 | Very high | 89.3 | Confident | 78 Ų | 78 | 56.4 Ų | 56.4 | 41% | 0.408 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -65 | -42.5 | 174.5 | -68.3 | -175.1 | 0 | 0 | 0 | 112.1 | F75 R76 S82 G83 | F75-L79 HydrophobicContact CD1-CD1 3.91Å; F75-L79 HydrophobicContact CD1-CG 4.2Å; F75-L79 HydrophobicContact CE1-CD1 3.48Å; F75-L79 VanDerWaalsContact CE1-CD1 3.48Å; F75-L79 HydrophobicContact CE1-CD2 4.29Å; F75-L79 HydrophobicContact CE1-CG 3.91Å; F75-L79 HydrophobicContact CZ-CD1 4.14Å; F75-L79 HydrophobicContact CZ-CD2 4.12Å; F75-L79 HydrophobicContact CZ-CG 4.21Å; F75-L79 WeakPolarHBondContact O-CG 3.3Å; F75-L79 PolarHBondContact O-N 3.28Å; R76-L79 PolarHBondContact O-N 2.95Å; L79-S82 PolarHBondContact O-N 3.18Å; L79-G83 PolarHBondContact O-N 2.85Å |
| 80 | L | 93.8 | Very high | 88.7 | Confident | 104 Ų | 104 | 58.6 Ų | 58.6 | 55% | 0.545 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -63 | -45.2 | 176.5 | -72.6 | 174.2 | 0 | 0 | 0 | 111.3 | R76 N77 S82 G83 I84 | R76-L80 HydrophobicContact CG-CD1 4.16Å; R76-L80 HydrophobicContact CG-CG 4.44Å; R76-L80 WeakPolarHBondContact O-CB 3.39Å; R76-L80 VanDerWaalsContact O-CG 3.31Å; R76-L80 WeakPolarHBondContact O-CG 3.22Å; R76-L80 PolarHBondContact O-N 3.49Å; N77-L80 PolarHBondContact O-N 2.84Å; L80-S82 VanDerWaalsContact C-N 3.34Å; L80-S82 PolarHBondContact O-N 3.12Å; L80-G83 PolarHBondContact O-N 3.19Å; L80-I84 VanDerWaalsContact O-CG1 3.29Å; L80-I84 WeakPolarHBondContact O-CG1 3.17Å; L80-I84 PolarHBondContact O-N 2.83Å |
| 81 | A | 92.5 | Very high | 88.2 | Confident | 11 Ų | 11 | 63.4 Ų | 63.4 | 9% | 0.091 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -59 | -47.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111 | N77 G78 G83 I84 G85 F102 L105 | N77-A81 WeakPolarHBondContact O-CB 3.25Å; N77-A81 PolarHBondContact O-N 3.26Å; G78-A81 PolarHBondContact O-N 3.05Å; A81-G83 VanDerWaalsContact C-N 3.32Å; A81-G83 PolarHBondContact O-N 3.43Å; A81-I84 PolarHBondContact O-N 3.23Å; A81-G85 PolarHBondContact O-N 3.28Å; A81-F102 WeakPolarHBondContact O-CB 3.34Å; A81-L105 HydrophobicContact CB-CD2 4.41Å; A81-L105 HydrophobicContact CB-CG 4.43Å |
| 82 | S | 90.5 | Very high | 87.4 | Confident | 8 Ų | 8 | 65.4 Ų | 65.4 | 6% | 0.056 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -61.4 | -40.2 | 177.7 | -52 | 0 | 0 | 0 | 0 | 112.2 | G78 L79 L80 G85 V86 F103 W149 | G78-S82 WeakPolarHBondContact O-CB 3.32Å; G78-S82 PolarHBondContact O-N 3.27Å; G78-S82 PolarHBondContact O-OG 3.4Å; L79-S82 PolarHBondContact O-N 3.18Å; L80-S82 VanDerWaalsContact C-N 3.34Å; L80-S82 PolarHBondContact O-N 3.12Å; S82-G85 WeakPolarHBondContact O-CA 3.33Å; S82-G85 PolarHBondContact O-N 3.22Å; S82-V86 PolarHBondContact O-N 2.97Å; S82-F103 WeakPolarHBondContact O-CE1 3.36Å; S82-W149 PolarHBondContact OG-NE1 3.17Å |
| 83 | G | 90 | Very high | 86.5 | Confident | 32 Ų | 32 | 66.3 Ų | 66.3 | 33% | 0.33 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -65.5 | -39 | 176 | 0 | 0 | 0 | 0 | 0 | 113.1 | L79 L80 A81 G85 V86 I87 | L79-G83 PolarHBondContact O-N 2.85Å; L80-G83 PolarHBondContact O-N 3.19Å; A81-G83 VanDerWaalsContact C-N 3.32Å; A81-G83 PolarHBondContact O-N 3.43Å; G83-G85 VanDerWaalsContact C-N 3.29Å; G83-G85 PolarHBondContact O-N 2.91Å; G83-V86 PolarHBondContact O-N 2.97Å; G83-I87 WeakPolarHBondContact O-CG1 3.39Å; G83-I87 PolarHBondContact O-N 3.46Å |
| 84 | I | 90.3 | Very high | 85.5 | Confident | 79 Ų | 79 | 71.3 Ų | 71.3 | 41% | 0.405 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -61.8 | -42.1 | 171.2 | -65.2 | 162.5 | 0 | 0 | 0 | 109.7 | L80 A81 V86 I87 S88 F102 | L80-I84 VanDerWaalsContact O-CG1 3.29Å; L80-I84 WeakPolarHBondContact O-CG1 3.17Å; L80-I84 PolarHBondContact O-N 2.83Å; A81-I84 PolarHBondContact O-N 3.23Å; I84-V86 VanDerWaalsContact C-N 3.34Å; I84-V86 PolarHBondContact O-N 3.23Å; I84-I87 PolarHBondContact O-N 2.89Å; I84-S88 WeakPolarHBondContact O-CB 3.35Å; I84-S88 PolarHBondContact O-N 3.32Å; I84-S88 PolarHBondContact O-OG 2.88Å; I84-S88 VanDerWaalsContact O-OG 3.08Å; I84-F102 HydrophobicContact CB-CD1 4.41Å; I84-F102 HydrophobicContact CB-CG 4.49Å; I84-F102 HydrophobicContact CG2-CD1 4.08Å; I84-F102 HydrophobicContact CG2-CD2 3.93Å; I84-F102 HydrophobicContact CG2-CE1 3.92Å; I84-F102 HydrophobicContact CG2-CE2 3.77Å; I84-F102 HydrophobicContact CG2-CG 4.11Å; I84-F102 HydrophobicContact CG2-CZ 3.76Å |
| 85 | G | 88.9 | Confident | 84.7 | Confident | 0 Ų | 0 | 66.1 Ų | 66.1 | 0% | 0 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -55.7 | -46.4 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113 | A81 S82 G83 I87 S88 F89 A99 | A81-G85 PolarHBondContact O-N 3.28Å; S82-G85 WeakPolarHBondContact O-CA 3.33Å; S82-G85 PolarHBondContact O-N 3.22Å; G83-G85 VanDerWaalsContact C-N 3.29Å; G83-G85 PolarHBondContact O-N 2.91Å; G85-I87 PolarHBondContact O-N 3.44Å; G85-S88 PolarHBondContact O-N 3.03Å; G85-F89 PolarHBondContact O-N 2.87Å; G85-F89 VanDerWaalsContact O-N 3.13Å; G85-A99 WeakPolarHBondContact O-CB 3.42Å |
| 86 | V | 86.3 | Confident | 84 | Confident | 52 Ų | 52 | 67.9 Ų | 67.9 | 32% | 0.315 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -60.7 | -42.4 | 176.1 | 172 | 0 | 0 | 0 | 0 | 112.2 | S82 G83 I84 M90 F103 Y156 | S82-V86 PolarHBondContact O-N 2.97Å; G83-V86 PolarHBondContact O-N 2.97Å; I84-V86 VanDerWaalsContact C-N 3.34Å; I84-V86 PolarHBondContact O-N 3.23Å; V86-M90 WeakPolarHBondContact O-CG 3.29Å; V86-M90 PolarHBondContact O-N 2.93Å; V86-F103 HydrophobicContact CG2-CE1 3.86Å; V86-F103 HydrophobicContact CG2-CZ 3.82Å; V86-Y156 WeakPolarHBondContact CA-OH 3.36Å; V86-Y156 HydrophobicContact CB-CE2 4.29Å; V86-Y156 HydrophobicContact CG1-CD2 4.43Å; V86-Y156 HydrophobicContact CG1-CE2 3.73Å; V86-Y156 HydrophobicContact CG2-CD1 4.34Å; V86-Y156 HydrophobicContact CG2-CD2 4.22Å; V86-Y156 HydrophobicContact CG2-CE1 4.2Å; V86-Y156 HydrophobicContact CG2-CE2 4.07Å; V86-Y156 HydrophobicContact CG2-CG 4.33Å; V86-Y156 PolarHBondContact O-OH 3.3Å |
| 87 | I | 86.9 | Confident | 83.5 | Confident | 98 Ų | 98 | 66.6 Ų | 66.6 | 50% | 0.503 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -71.4 | -42.9 | -179.6 | -64.9 | 164.8 | 0 | 0 | 0 | 110.9 | G83 I84 G85 F89 M90 Q91 | G83-I87 WeakPolarHBondContact O-CG1 3.39Å; G83-I87 PolarHBondContact O-N 3.46Å; I84-I87 PolarHBondContact O-N 2.89Å; G85-I87 PolarHBondContact O-N 3.44Å; I87-F89 VanDerWaalsContact C-N 3.27Å; I87-F89 PolarHBondContact O-N 2.72Å; I87-M90 PolarHBondContact O-N 2.88Å; I87-M90 VanDerWaalsContact O-N 3.16Å; I87-Q91 WeakPolarHBondContact O-CG 3.34Å; I87-Q91 PolarHBondContact O-N 3.44Å |
| 88 | S | 84.1 | Confident | 83 | Confident | 22 Ų | 22 | 65.6 Ų | 65.6 | 15% | 0.154 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -59.5 | -39.9 | 179.6 | -69.1 | 0 | 0 | 0 | 0 | 112 | I84 G85 M90 Q91 G95 | I84-S88 WeakPolarHBondContact O-CB 3.35Å; I84-S88 PolarHBondContact O-N 3.32Å; I84-S88 PolarHBondContact O-OG 2.88Å; I84-S88 VanDerWaalsContact O-OG 3.08Å; G85-S88 PolarHBondContact O-N 3.03Å; S88-M90 PolarHBondContact O-N 3.38Å; S88-Q91 PolarHBondContact O-N 2.83Å; S88-G95 WeakPolarHBondContact O-CA 3.49Å |
| 89 | F | 75.8 | Confident | 82.8 | Confident | 35 Ų | 35 | 65.7 Ų | 65.7 | 15% | 0.154 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -61.7 | -41.7 | 175.9 | 176.6 | -93 | 0 | 0 | 0 | 112.7 | G85 I87 Q91 R96 A99 Y156 L160 | G85-F89 PolarHBondContact O-N 2.87Å; G85-F89 VanDerWaalsContact O-N 3.13Å; I87-F89 VanDerWaalsContact C-N 3.27Å; I87-F89 PolarHBondContact O-N 2.72Å; F89-Q91 PolarHBondContact O-N 3.35Å; F89-R96 HydrophobicContact CD2-CB 3.95Å; F89-R96 HydrophobicContact CD2-CG 3.97Å; F89-R96 HydrophobicContact CE2-CB 4.06Å; F89-R96 HydrophobicContact CE2-CG 3.84Å; F89-A99 HydrophobicContact CB-CB 3.88Å; F89-Y156 HydrophobicContact CB-CE1 4.39Å; F89-Y156 WeakPolarHBondContact CB-OH 3.21Å; F89-Y156 HydrophobicContact CD1-CE1 4.47Å; F89-Y156 AromaticContact CD1-CZ 3.88Å; F89-Y156 WeakPolarHBondContact CD1-OH 3.36Å; F89-Y156 HydrophobicContact CG-CE1 4.35Å; F89-Y156 VanDerWaalsContact CG-OH 3.25Å; F89-Y156 WeakPolarHBondContact CG-OH 3.39Å; F89-L160 HydrophobicContact CD1-CD2 3.77Å; F89-L160 HydrophobicContact CD2-CD1 4.46Å; F89-L160 HydrophobicContact CD2-CD2 3.5Å; F89-L160 HydrophobicContact CE1-CD2 3.33Å; F89-L160 HydrophobicContact CE2-CD1 4.47Å; F89-L160 HydrophobicContact CE2-CD2 3.09Å; F89-L160 HydrophobicContact CE2-CG 4.31Å; F89-L160 HydrophobicContact CG-CD2 3.85Å; F89-L160 HydrophobicContact CZ-CD2 3Å; F89-L160 HydrophobicContact CZ-CG 4.42Å |
| 90 | M | 76.8 | Confident | 82.4 | Confident | 131 Ų | 131 | 65.7 Ų | 65.7 | 65% | 0.645 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -69.5 | -11.8 | -178.4 | -69.5 | -69.5 | 149.5 | 0 | 0 | 113.9 | V86 I87 S88 Y156 | V86-M90 WeakPolarHBondContact O-CG 3.29Å; V86-M90 PolarHBondContact O-N 2.93Å; I87-M90 PolarHBondContact O-N 2.88Å; I87-M90 VanDerWaalsContact O-N 3.16Å; S88-M90 PolarHBondContact O-N 3.38Å; M90-Y156 HydrophobicContact CE-CE2 4.16Å |
| 91 | Q | 77.8 | Confident | 82.2 | Confident | 149 Ų | 149 | 62.7 Ų | 62.7 | 70% | 0.696 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -94.8 | -29.4 | -172.6 | -73.2 | -177.8 | -2.1 | 0 | 0 | 114.4 | I87 S88 F89 | I87-Q91 WeakPolarHBondContact O-CG 3.34Å; I87-Q91 PolarHBondContact O-N 3.44Å; S88-Q91 PolarHBondContact O-N 2.83Å; F89-Q91 PolarHBondContact O-N 3.35Å |
| 92 | S | 72.4 | Confident | 82.1 | Confident | 65 Ų | 65 | 65.3 Ų | 65.3 | 46% | 0.455 | 35% | 0.352 | S | S | . | . | trans | -173.6 | 163.5 | 176.8 | 64 | 0 | 0 | 0 | 0 | 112.8 | M94 G95 R96 | S92-M94 PolarHBondContact O-N 3.49Å; S92-G95 VanDerWaalsContact O-CA 3.31Å; S92-G95 WeakPolarHBondContact O-CA 3.43Å; S92-G95 PolarHBondContact O-N 3.43Å; S92-G95 PolarHBondContact OG-N 3.45Å; S92-G95 VanDerWaalsContact OG-N 3.13Å; S92-R96 PolarHBondContact O-N 3.35Å | ||
| 93 | D | 70.3 | Confident | 82 | Confident | 118 Ų | 118 | 65.5 Ų | 65.5 | 63% | 0.631 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -57.6 | -33.3 | 171.2 | -72 | -58.2 | 0 | 0 | 0 | 113.7 | G95 R96 | D93-G95 VanDerWaalsContact C-N 3.26Å; D93-G95 PolarHBondContact O-N 3.26Å; D93-R96 WeakPolarHBondContact O-CB 3.45Å; D93-R96 PolarHBondContact O-N 3.1Å; D93-R96 IonicContact OD1-CZ 3.73Å; D93-R96 IonicContact OD1-NH1 3.69Å; D93-R96 PolarHBondContact OD1-NH1 2.86Å; D93-R96 IonicContact OD1-NH2 2.74Å |
| 94 | M | 70.8 | Confident | 82 | Confident | 151 Ų | 151 | 70.4 Ų | 70.4 | 74% | 0.744 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -70.5 | -25.9 | 173.4 | -165.6 | 67.1 | -152.4 | 0 | 0 | 112.1 | S92 R96 | S92-M94 PolarHBondContact O-N 3.49Å; M94-R96 VanDerWaalsContact C-N 3.27Å; M94-R96 PolarHBondContact O-N 2.92Å |
| 95 | G | 73.4 | Confident | 82.1 | Confident | 8 Ų | 8 | 71 Ų | 71 | 8% | 0.082 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -70.9 | -19.5 | 175 | 0 | 0 | 0 | 0 | 0 | 113.8 | S88 S92 D93 A98 A99 | S88-G95 WeakPolarHBondContact O-CA 3.49Å; S92-G95 VanDerWaalsContact O-CA 3.31Å; S92-G95 WeakPolarHBondContact O-CA 3.43Å; S92-G95 PolarHBondContact O-N 3.43Å; S92-G95 PolarHBondContact OG-N 3.45Å; S92-G95 VanDerWaalsContact OG-N 3.13Å; D93-G95 VanDerWaalsContact C-N 3.26Å; D93-G95 PolarHBondContact O-N 3.26Å; G95-A98 PolarHBondContact O-N 2.97Å; G95-A99 WeakPolarHBondContact O-CB 3.43Å; G95-A99 PolarHBondContact O-N 3.44Å |
| 96 | R | 75.4 | Confident | 82.3 | Confident | 70 Ų | 70 | 71 Ų | 71 | 26% | 0.264 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -63.8 | -45.6 | 175.6 | -178.2 | 170.7 | 57.6 | -117.9 | -0.2 | 112.2 | F89 S92 D93 M94 A98 A99 Y100 | F89-R96 HydrophobicContact CD2-CB 3.95Å; F89-R96 HydrophobicContact CD2-CG 3.97Å; F89-R96 HydrophobicContact CE2-CB 4.06Å; F89-R96 HydrophobicContact CE2-CG 3.84Å; S92-R96 PolarHBondContact O-N 3.35Å; D93-R96 WeakPolarHBondContact O-CB 3.45Å; D93-R96 PolarHBondContact O-N 3.1Å; D93-R96 IonicContact OD1-CZ 3.73Å; D93-R96 IonicContact OD1-NH1 3.69Å; D93-R96 PolarHBondContact OD1-NH1 2.86Å; D93-R96 IonicContact OD1-NH2 2.74Å; M94-R96 VanDerWaalsContact C-N 3.27Å; M94-R96 PolarHBondContact O-N 2.92Å; R96-A98 VanDerWaalsContact C-N 3.33Å; R96-A98 PolarHBondContact O-N 3.49Å; R96-A99 WeakPolarHBondContact O-CB 3.48Å; R96-A99 PolarHBondContact O-N 2.87Å; R96-Y100 HydrophobicContact CG-CE2 3.82Å; R96-Y100 WeakPolarHBondContact O-CD2 3.36Å; R96-Y100 PolarHBondContact O-N 3.5Å |
| 97 | E | 80.5 | Confident | 82.5 | Confident | 123 Ų | 123 | 69 Ų | 69 | 58% | 0.575 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -63.3 | -39.8 | 175.8 | -69.5 | -60.9 | 151.6 | 0 | 0 | 112.1 | A99 | E97-A99 VanDerWaalsContact C-N 3.35Å |
| 98 | A | 84.1 | Confident | 82.8 | Confident | 44 Ų | 44 | 69.5 Ų | 69.5 | 36% | 0.364 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -67.7 | -35.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | G95 R96 Y100 G101 F102 | G95-A98 PolarHBondContact O-N 2.97Å; R96-A98 VanDerWaalsContact C-N 3.33Å; R96-A98 PolarHBondContact O-N 3.49Å; A98-Y100 PolarHBondContact O-N 2.81Å; A98-G101 PolarHBondContact O-N 3.2Å; A98-F102 HydrophobicContact CB-CE2 4.31Å; A98-F102 WeakPolarHBondContact O-CD2 3.39Å; A98-F102 PolarHBondContact O-N 2.84Å |
| 99 | A | 85.7 | Confident | 83.1 | Confident | 1 Ų | 1 | 69.2 Ų | 69.2 | 1% | 0.008 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -60.7 | -44.6 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | G85 F89 G95 R96 E97 G101 F102 F103 | G85-A99 WeakPolarHBondContact O-CB 3.42Å; F89-A99 HydrophobicContact CB-CB 3.88Å; G95-A99 WeakPolarHBondContact O-CB 3.43Å; G95-A99 PolarHBondContact O-N 3.44Å; R96-A99 WeakPolarHBondContact O-CB 3.48Å; R96-A99 PolarHBondContact O-N 2.87Å; E97-A99 VanDerWaalsContact C-N 3.35Å; A99-G101 VanDerWaalsContact C-N 3.29Å; A99-G101 PolarHBondContact O-N 2.97Å; A99-F102 PolarHBondContact O-N 3.46Å; A99-F102 VanDerWaalsContact O-N 3.12Å; A99-F103 HydrophobicContact CB-CD2 4.35Å; A99-F103 HydrophobicContact CB-CE2 3.89Å; A99-F103 WeakPolarHBondContact O-CD2 3.47Å; A99-F103 WeakPolarHBondContact O-CG 3.34Å; A99-F103 PolarHBondContact O-N 2.92Å |
| 100 | Y | 84.4 | Confident | 83.8 | Confident | 79 Ų | 79 | 67.6 Ų | 67.6 | 31% | 0.31 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -57.5 | -42.2 | 174.8 | -64.6 | -57.5 | 0 | 0 | 0 | 112.2 | R96 A98 F102 F103 L104 M157 L160 | R96-Y100 HydrophobicContact CG-CE2 3.82Å; R96-Y100 WeakPolarHBondContact O-CD2 3.36Å; R96-Y100 PolarHBondContact O-N 3.5Å; A98-Y100 PolarHBondContact O-N 2.81Å; Y100-F102 PolarHBondContact O-N 3.33Å; Y100-F103 PolarHBondContact O-N 2.96Å; Y100-L104 WeakPolarHBondContact O-CG 3.4Å; Y100-L104 PolarHBondContact O-N 3.48Å; Y100-M157 HydrophobicContact CD1-CE 3.64Å; Y100-M157 HydrophobicContact CD1-SD 3.84Å; Y100-M157 HydrophobicContact CE1-CE 3.35Å; Y100-M157 HydrophobicContact CE1-SD 3.59Å; Y100-M157 VanDerWaalsContact CE1-SD 3.59Å; Y100-L160 HydrophobicContact CE1-CD1 4.07Å |
| 101 | G | 89.4 | Confident | 84.4 | Confident | 41 Ų | 41 | 65.8 Ų | 65.8 | 42% | 0.423 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -60.5 | -43.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | A98 A99 L104 L105 | A98-G101 PolarHBondContact O-N 3.2Å; A99-G101 VanDerWaalsContact C-N 3.29Å; A99-G101 PolarHBondContact O-N 2.97Å; G101-L104 PolarHBondContact O-N 2.87Å; G101-L105 WeakPolarHBondContact O-CB 3.35Å; G101-L105 PolarHBondContact O-N 3.16Å |
| 102 | F | 89.8 | Confident | 85 | Confident | 65 Ų | 65 | 64.5 Ų | 64.5 | 29% | 0.285 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -69 | -34.9 | 176.5 | -74.9 | -60 | 0 | 0 | 0 | 113.2 | A81 I84 A98 A99 Y100 G106 | A81-F102 WeakPolarHBondContact O-CB 3.34Å; I84-F102 HydrophobicContact CB-CD1 4.41Å; I84-F102 HydrophobicContact CB-CG 4.49Å; I84-F102 HydrophobicContact CG2-CD1 4.08Å; I84-F102 HydrophobicContact CG2-CD2 3.93Å; I84-F102 HydrophobicContact CG2-CE1 3.92Å; I84-F102 HydrophobicContact CG2-CE2 3.77Å; I84-F102 HydrophobicContact CG2-CG 4.11Å; I84-F102 HydrophobicContact CG2-CZ 3.76Å; A98-F102 HydrophobicContact CB-CE2 4.31Å; A98-F102 WeakPolarHBondContact O-CD2 3.39Å; A98-F102 PolarHBondContact O-N 2.84Å; A99-F102 PolarHBondContact O-N 3.46Å; A99-F102 VanDerWaalsContact O-N 3.12Å; Y100-F102 PolarHBondContact O-N 3.33Å; F102-G106 PolarHBondContact O-N 3.21Å |
| 103 | F | 89.6 | Confident | 85.8 | Confident | 12 Ų | 12 | 61.5 Ų | 61.5 | 5% | 0.053 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -67.8 | -41.3 | 173 | -68.4 | -52.6 | 0 | 0 | 0 | 112.4 | S82 V86 A99 Y100 G106 G107 V153 Y156 M157 | S82-F103 WeakPolarHBondContact O-CE1 3.36Å; V86-F103 HydrophobicContact CG2-CE1 3.86Å; V86-F103 HydrophobicContact CG2-CZ 3.82Å; A99-F103 HydrophobicContact CB-CD2 4.35Å; A99-F103 HydrophobicContact CB-CE2 3.89Å; A99-F103 WeakPolarHBondContact O-CD2 3.47Å; A99-F103 WeakPolarHBondContact O-CG 3.34Å; A99-F103 PolarHBondContact O-N 2.92Å; Y100-F103 PolarHBondContact O-N 2.96Å; F103-G106 PolarHBondContact O-N 3.47Å; F103-G107 PolarHBondContact O-N 2.82Å; F103-V153 HydrophobicContact CB-CG1 4.46Å; F103-V153 HydrophobicContact CD1-CG1 3.94Å; F103-V153 HydrophobicContact CD1-CG2 4.12Å; F103-V153 HydrophobicContact CE1-CG1 4.47Å; F103-V153 HydrophobicContact CE1-CG2 4.44Å; F103-V153 HydrophobicContact CG-CG1 4.2Å; F103-Y156 HydrophobicContact CE1-CD1 4.25Å; F103-Y156 HydrophobicContact CE1-CE1 4.49Å; F103-Y156 AromaticContact CE2-CD1 3.81Å; F103-Y156 HydrophobicContact CE2-CD1 3.81Å; F103-Y156 AromaticContact CE2-CE1 3.66Å; F103-Y156 HydrophobicContact CE2-CE1 3.66Å; F103-Y156 AromaticContact CZ-CD1 3.39Å; F103-Y156 HydrophobicContact CZ-CD1 3.39Å; F103-Y156 AromaticContact CZ-CE1 3.34Å; F103-Y156 HydrophobicContact CZ-CE1 3.34Å; F103-Y156 HydrophobicContact CZ-CG 4.44Å; F103-M157 HydrophobicContact CD2-SD 4.07Å; F103-M157 HydrophobicContact CE2-SD 4.35Å |
| 104 | L | 90.4 | Very high | 86.7 | Confident | 136 Ų | 136 | 56.2 Ų | 56.2 | 71% | 0.712 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -63.8 | -42.6 | 174.2 | -72 | 175.4 | 0 | 0 | 0 | 111.6 | Y100 G101 G107 L108 | Y100-L104 WeakPolarHBondContact O-CG 3.4Å; Y100-L104 PolarHBondContact O-N 3.48Å; G101-L104 PolarHBondContact O-N 2.87Å; L104-G107 PolarHBondContact O-N 2.92Å; L104-L108 VanDerWaalsContact O-CB 3.3Å; L104-L108 WeakPolarHBondContact O-CB 3.43Å; L104-L108 PolarHBondContact O-N 3.37Å |
| 105 | L | 92 | Very high | 87.5 | Confident | 91 Ų | 91 | 51.3 Ų | 51.3 | 48% | 0.476 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -65.2 | -40.9 | 175.3 | -175.3 | 63.3 | 0 | 0 | 0 | 111.6 | A81 G101 L108 C109 | A81-L105 HydrophobicContact CB-CD2 4.41Å; A81-L105 HydrophobicContact CB-CG 4.43Å; G101-L105 WeakPolarHBondContact O-CB 3.35Å; G101-L105 PolarHBondContact O-N 3.16Å; L105-L108 PolarHBondContact O-N 3.31Å; L105-C109 PolarHBondContact O-N 3.46Å |
| 106 | G | 91.9 | Very high | 88.1 | Confident | 0 Ų | 0 | 51.7 Ų | 51.7 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -58.1 | -51.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | G78 F102 F103 C109 V110 | G78-G106 WeakPolarHBondContact O-CA 3.4Å; F102-G106 PolarHBondContact O-N 3.21Å; F103-G106 PolarHBondContact O-N 3.47Å; G106-C109 WeakPolarHBondContact O-CB 3.5Å; G106-C109 PolarHBondContact O-N 3.02Å; G106-V110 WeakPolarHBondContact O-CG2 3.49Å; G106-V110 PolarHBondContact O-N 2.91Å |
| 107 | G | 90.3 | Very high | 88.7 | Confident | 10 Ų | 10 | 49.7 Ų | 49.7 | 10% | 0.103 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -63.6 | -42.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | F103 L104 C109 V110 V111 W149 | F103-G107 PolarHBondContact O-N 2.82Å; L104-G107 PolarHBondContact O-N 2.92Å; G107-C109 VanDerWaalsContact C-N 3.31Å; G107-C109 PolarHBondContact O-N 3.28Å; G107-V110 PolarHBondContact O-N 3.29Å; G107-V111 WeakPolarHBondContact O-CB 3.36Å; G107-V111 VanDerWaalsContact O-CG2 3.25Å; G107-V111 WeakPolarHBondContact O-CG2 3.38Å; G107-V111 PolarHBondContact O-N 3.5Å; G107-W149 VanDerWaalsContact N-CZ2 3.29Å |
| 108 | L | 93.1 | Very high | 89 | Confident | 109 Ų | 109 | 45.4 Ų | 45.4 | 57% | 0.571 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -59 | -44.1 | 173.7 | -178.7 | 63.2 | 0 | 0 | 0 | 111.1 | L104 L105 W112 | L104-L108 VanDerWaalsContact O-CB 3.3Å; L104-L108 WeakPolarHBondContact O-CB 3.43Å; L104-L108 PolarHBondContact O-N 3.37Å; L105-L108 PolarHBondContact O-N 3.31Å; L108-W112 WeakPolarHBondContact O-CA 3.48Å; L108-W112 WeakPolarHBondContact O-CB 3.3Å; L108-W112 PolarHBondContact O-N 3.06Å |
| 109 | C | 91.1 | Very high | 89.1 | Confident | 15 Ų | 15 | 46.6 Ų | 46.6 | 10% | 0.101 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -61.4 | -46.4 | 175.9 | -105.6 | 0 | 0 | 0 | 0 | 112.6 | W74 L105 G106 G107 G113 | W74-C109 WeakPolarHBondContact O-CB 3.45Å; L105-C109 PolarHBondContact O-N 3.46Å; G106-C109 WeakPolarHBondContact O-CB 3.5Å; G106-C109 PolarHBondContact O-N 3.02Å; G107-C109 VanDerWaalsContact C-N 3.31Å; G107-C109 PolarHBondContact O-N 3.28Å; C109-G113 WeakPolarHBondContact O-CA 3.3Å; C109-G113 PolarHBondContact O-N 3.12Å |
| 110 | V | 90.9 | Very high | 89 | Confident | 1 Ų | 1 | 46.6 Ų | 46.6 | 1% | 0.006 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -66 | -48.7 | -178.7 | 172.1 | 0 | 0 | 0 | 0 | 110.7 | F75 G106 G107 G114 W149 | F75-V110 HydrophobicContact CD2-CG1 4.21Å; F75-V110 HydrophobicContact CD2-CG2 4.01Å; F75-V110 HydrophobicContact CE2-CG1 4.03Å; F75-V110 HydrophobicContact CE2-CG2 4.08Å; G106-V110 WeakPolarHBondContact O-CG2 3.49Å; G106-V110 PolarHBondContact O-N 2.91Å; G107-V110 PolarHBondContact O-N 3.29Å; V110-G114 PolarHBondContact O-N 3.03Å; V110-W149 HydrophobicContact CB-CD2 4.37Å; V110-W149 HydrophobicContact CB-CE3 4.41Å; V110-W149 HydrophobicContact CG1-CD2 4.31Å; V110-W149 HydrophobicContact CG1-CE3 4.18Å; V110-W149 HydrophobicContact CG2-CD2 4.04Å; V110-W149 HydrophobicContact CG2-CG 4.11Å |
| 111 | V | 89.9 | Confident | 88.9 | Confident | 94 Ų | 94 | 43 Ų | 43 | 57% | 0.57 | 25% | 0.247 | S | C | * | . | H | α-helix | trans | -69.7 | -47.1 | -178.4 | 176.4 | 0 | 0 | 0 | 0 | 111.1 | G107 G114 A115 | G107-V111 WeakPolarHBondContact O-CB 3.36Å; G107-V111 VanDerWaalsContact O-CG2 3.25Å; G107-V111 WeakPolarHBondContact O-CG2 3.38Å; G107-V111 PolarHBondContact O-N 3.5Å; V111-G114 PolarHBondContact O-N 3.38Å; V111-A115 WeakPolarHBondContact O-CB 3.35Å; V111-A115 PolarHBondContact O-N 2.93Å |
| 112 | W | 90.1 | Very high | 88.5 | Confident | 122 Ų | 122 | 44.9 Ų | 44.9 | 46% | 0.462 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -66.3 | -42.7 | 178.6 | -174.9 | -96.1 | 0 | 0 | 0 | 111.8 | W7 L108 S116 | W7-W112 AromaticContact CE2-CZ2 3.99Å; W7-W112 HydrophobicContact CH2-CH2 4.48Å; W7-W112 HydrophobicContact CH2-CZ2 4.17Å; W7-W112 AromaticContact CZ2-CE2 4Å; W7-W112 HydrophobicContact CZ2-CH2 4.09Å; W7-W112 AromaticContact CZ2-CZ2 3.41Å; W7-W112 HydrophobicContact CZ2-CZ2 3.41Å; W7-W112 VanDerWaalsContact CZ2-CZ2 3.41Å; L108-W112 WeakPolarHBondContact O-CA 3.48Å; L108-W112 WeakPolarHBondContact O-CB 3.3Å; L108-W112 PolarHBondContact O-N 3.06Å; W112-S116 WeakPolarHBondContact O-CB 3.27Å; W112-S116 PolarHBondContact O-N 2.87Å; W112-S116 PolarHBondContact O-OG 3.18Å |
| 113 | G | 89.4 | Confident | 87.9 | Confident | 1 Ų | 1 | 43.7 Ų | 43.7 | 1% | 0.01 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -60.5 | -48.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | C109 S116 Y117 | C109-G113 WeakPolarHBondContact O-CA 3.3Å; C109-G113 PolarHBondContact O-N 3.12Å; G113-S116 PolarHBondContact O-N 3.23Å; G113-Y117 WeakPolarHBondContact O-CB 3.49Å; G113-Y117 PolarHBondContact O-N 3.44Å |
| 114 | G | 87.8 | Confident | 87.1 | Confident | 7 Ų | 7 | 43.9 Ų | 43.9 | 7% | 0.072 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -66.1 | -43.9 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | V110 V111 Y117 A118 V142 | V110-G114 PolarHBondContact O-N 3.03Å; V111-G114 PolarHBondContact O-N 3.38Å; G114-Y117 WeakPolarHBondContact O-CB 3.47Å; G114-Y117 PolarHBondContact O-N 3.44Å; G114-A118 WeakPolarHBondContact O-CB 3.41Å; G114-A118 PolarHBondContact O-N 3.46Å; G114-V142 VanDerWaalsContact CA-CG1 3.46Å |
| 115 | A | 87.8 | Confident | 86.4 | Confident | 49 Ų | 49 | 42.2 Ų | 42.2 | 41% | 0.405 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -63.8 | -44.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | V111 Y117 A118 V119 | V111-A115 WeakPolarHBondContact O-CB 3.35Å; V111-A115 PolarHBondContact O-N 2.93Å; A115-Y117 VanDerWaalsContact C-N 3.28Å; A115-Y117 PolarHBondContact O-N 2.74Å; A115-A118 PolarHBondContact O-N 2.78Å; A115-V119 WeakPolarHBondContact O-CB 3.35Å; A115-V119 VanDerWaalsContact O-CG2 3.3Å; A115-V119 WeakPolarHBondContact O-CG2 3.4Å; A115-V119 PolarHBondContact O-N 3.34Å |
| 116 | S | 86.9 | Confident | 85.4 | Confident | 15 Ų | 15 | 40.8 Ų | 40.8 | 11% | 0.105 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -61.9 | -37.9 | 175.8 | -60.5 | 0 | 0 | 0 | 0 | 111.5 | W112 G113 G120 | W112-S116 WeakPolarHBondContact O-CB 3.27Å; W112-S116 PolarHBondContact O-N 2.87Å; W112-S116 PolarHBondContact O-OG 3.18Å; G113-S116 PolarHBondContact O-N 3.23Å; S116-G120 PolarHBondContact O-N 2.94Å |
| 117 | Y | 87.8 | Confident | 84.3 | Confident | 28 Ų | 28 | 44.3 Ų | 44.3 | 11% | 0.11 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -64.9 | -48.4 | 175.1 | -179.8 | -103 | 0 | 0 | 0 | 111.9 | H67 F71 G113 G114 A115 G120 L121 V142 | H67-Y117 AromaticContact CD2-CD2 3.43Å; H67-Y117 VanDerWaalsContact CD2-CD2 3.43Å; H67-Y117 WeakPolarHBondContact CD2-CD2 3.47Å; H67-Y117 AromaticContact CD2-CE2 3.6Å; H67-Y117 WeakPolarHBondContact NE2-CA 3.29Å; H67-Y117 AromaticContact NE2-CD2 3.5Å; H67-Y117 PolarHBondContact NE2-O 3.38Å; F71-Y117 HydrophobicContact CB-CD2 3.64Å; F71-Y117 HydrophobicContact CB-CE2 4.37Å; F71-Y117 HydrophobicContact CB-CG 4.08Å; F71-Y117 HydrophobicContact CD2-CG 4.15Å; F71-Y117 AromaticContact CG-CD2 3.99Å; F71-Y117 HydrophobicContact CG-CD2 3.99Å; F71-Y117 HydrophobicContact CG-CG 4.03Å; G113-Y117 WeakPolarHBondContact O-CB 3.49Å; G113-Y117 PolarHBondContact O-N 3.44Å; G114-Y117 WeakPolarHBondContact O-CB 3.47Å; G114-Y117 PolarHBondContact O-N 3.44Å; A115-Y117 VanDerWaalsContact C-N 3.28Å; A115-Y117 PolarHBondContact O-N 2.74Å; Y117-G120 PolarHBondContact O-N 3.36Å; Y117-L121 HydrophobicContact CD1-CD1 3.56Å; Y117-L121 HydrophobicContact CD2-CD1 4.41Å; Y117-L121 HydrophobicContact CE1-CD1 3.09Å; Y117-L121 HydrophobicContact CE1-CG 4.49Å; Y117-L121 HydrophobicContact CE2-CD1 4.01Å; Y117-L121 HydrophobicContact CG-CD1 4.23Å; Y117-L121 WeakPolarHBondContact O-CB 2.99Å; Y117-L121 PolarHBondContact O-N 2.79Å; Y117-V142 HydrophobicContact CD1-CB 4.33Å; Y117-V142 HydrophobicContact CD1-CG2 3.38Å; Y117-V142 HydrophobicContact CE1-CG2 3.53Å; Y117-V142 HydrophobicContact CG-CG2 4.25Å |
| 118 | A | 86.9 | Confident | 83.3 | Confident | 34 Ų | 34 | 44 Ų | 44 | 28% | 0.281 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -63.3 | -44.6 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | G114 A115 L121 A122 V139 | G114-A118 WeakPolarHBondContact O-CB 3.41Å; G114-A118 PolarHBondContact O-N 3.46Å; A115-A118 PolarHBondContact O-N 2.78Å; A118-L121 WeakPolarHBondContact O-CB 3.4Å; A118-L121 PolarHBondContact O-N 2.96Å; A118-A122 PolarHBondContact O-N 2.86Å; A118-V139 HydrophobicContact CB-CG2 4.26Å |
| 119 | V | 85.3 | Confident | 82.3 | Confident | 69 Ų | 69 | 43.5 Ų | 43.5 | 42% | 0.418 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -63.1 | -43.6 | 175.3 | 171.4 | 0 | 0 | 0 | 0 | 110.9 | V10 A115 L121 A122 A123 | V10-V119 HydrophobicContact CG1-CG1 4.48Å; A115-V119 WeakPolarHBondContact O-CB 3.35Å; A115-V119 VanDerWaalsContact O-CG2 3.3Å; A115-V119 WeakPolarHBondContact O-CG2 3.4Å; A115-V119 PolarHBondContact O-N 3.34Å; V119-L121 VanDerWaalsContact C-N 3.34Å; V119-L121 PolarHBondContact O-N 3.29Å; V119-A122 PolarHBondContact O-N 3.48Å; V119-A123 WeakPolarHBondContact O-CB 3.09Å; V119-A123 PolarHBondContact O-N 3.25Å |
| 120 | G | 83.4 | Confident | 81.4 | Confident | 0 Ų | 0 | 44 Ų | 44 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -64.1 | -37.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | S116 Y117 A122 A123 L124 | S116-G120 PolarHBondContact O-N 2.94Å; Y117-G120 PolarHBondContact O-N 3.36Å; G120-A122 PolarHBondContact O-N 3.4Å; G120-A123 PolarHBondContact O-N 3.45Å; G120-L124 WeakPolarHBondContact O-CA 3.44Å; G120-L124 WeakPolarHBondContact O-CB 3.21Å; G120-L124 WeakPolarHBondContact O-CG 3.4Å; G120-L124 PolarHBondContact O-N 3.22Å |
| 121 | L | 84 | Confident | 80.9 | Confident | 5 Ų | 5 | 47.4 Ų | 47.4 | 3% | 0.026 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -60.2 | -44.5 | 172.5 | -107.4 | 146.2 | 0 | 0 | 0 | 112.1 | Y117 A118 V119 R125 L130 A135 V139 | Y117-L121 HydrophobicContact CD1-CD1 3.56Å; Y117-L121 HydrophobicContact CD2-CD1 4.41Å; Y117-L121 HydrophobicContact CE1-CD1 3.09Å; Y117-L121 HydrophobicContact CE1-CG 4.49Å; Y117-L121 HydrophobicContact CE2-CD1 4.01Å; Y117-L121 HydrophobicContact CG-CD1 4.23Å; Y117-L121 WeakPolarHBondContact O-CB 2.99Å; Y117-L121 PolarHBondContact O-N 2.79Å; A118-L121 WeakPolarHBondContact O-CB 3.4Å; A118-L121 PolarHBondContact O-N 2.96Å; V119-L121 VanDerWaalsContact C-N 3.34Å; V119-L121 PolarHBondContact O-N 3.29Å; L121-R125 VanDerWaalsContact O-CB 3.31Å; L121-R125 WeakPolarHBondContact O-CB 3.41Å; L121-R125 PolarHBondContact O-N 2.92Å; L121-R125 VanDerWaalsContact O-N 3.09Å; L121-L130 HydrophobicContact CD2-CD1 4.35Å; L121-L130 HydrophobicContact CD2-CD2 4.22Å; L121-A135 HydrophobicContact CD2-CB 3.61Å; L121-V139 HydrophobicContact CD1-CG2 4.34Å |
| 122 | A | 80.4 | Confident | 80.3 | Confident | 79 Ų | 79 | 48 Ų | 48 | 65% | 0.653 | 29% | 0.291 | S | S | * | . | H | α-helix | trans | -66.1 | -41.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | A118 V119 G120 | A118-A122 PolarHBondContact O-N 2.86Å; V119-A122 PolarHBondContact O-N 3.48Å; G120-A122 PolarHBondContact O-N 3.4Å |
| 123 | A | 77.3 | Confident | 79.8 | Confident | 40 Ų | 40 | 45.2 Ų | 45.2 | 33% | 0.331 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -75.4 | -35.7 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | V10 V119 G120 | V10-A123 HydrophobicContact CG1-CB 4.33Å; V119-A123 WeakPolarHBondContact O-CB 3.09Å; V119-A123 PolarHBondContact O-N 3.25Å; G120-A123 PolarHBondContact O-N 3.45Å |
| 124 | L | 72.8 | Confident | 79.4 | Confident | 17 Ų | 17 | 46.7 Ų | 46.7 | 9% | 0.089 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -101.9 | 5.8 | -173.6 | -59 | 162.4 | 0 | 0 | 0 | 112.9 | L63 G120 G126 P127 M128 | L63-L124 HydrophobicContact CD1-CD1 4.44Å; L63-L124 HydrophobicContact CD1-CD2 4.45Å; L63-L124 HydrophobicContact CD2-CB 4.44Å; L63-L124 HydrophobicContact CD2-CD2 4.06Å; G120-L124 WeakPolarHBondContact O-CA 3.44Å; G120-L124 WeakPolarHBondContact O-CB 3.21Å; G120-L124 WeakPolarHBondContact O-CG 3.4Å; G120-L124 PolarHBondContact O-N 3.22Å; L124-G126 VanDerWaalsContact C-N 3.31Å; L124-G126 PolarHBondContact O-N 3.3Å; L124-P127 VanDerWaalsContact O-CD 3.28Å; L124-P127 WeakPolarHBondContact O-CD 3.31Å; L124-M128 HydrophobicContact CB-CG 4.08Å; L124-M128 HydrophobicContact CB-SD 3.55Å; L124-M128 VanDerWaalsContact CB-SD 3.55Å; L124-M128 HydrophobicContact CD1-SD 4.34Å; L124-M128 VanDerWaalsContact O-CB 3.26Å; L124-M128 WeakPolarHBondContact O-CB 3.36Å; L124-M128 WeakPolarHBondContact O-CG 3.49Å; L124-M128 PolarHBondContact O-N 3.32Å |
| 125 | R | 75.1 | Confident | 79.2 | Confident | 101 Ų | 101 | 46.9 Ų | 46.9 | 38% | 0.381 | 31% | 0.311 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54 | -43 | -179.2 | -171.3 | 174.5 | 167.8 | -164.6 | -9.5 | 114.2 | L121 Q129 L130 | L121-R125 VanDerWaalsContact O-CB 3.31Å; L121-R125 WeakPolarHBondContact O-CB 3.41Å; L121-R125 PolarHBondContact O-N 2.92Å; L121-R125 VanDerWaalsContact O-N 3.09Å; R125-Q129 PolarHBondContact O-N 3.34Å; R125-L130 PolarHBondContact O-N 3.19Å; R125-L130 VanDerWaalsContact O-N 3.16Å |
| 126 | G | 71.4 | Confident | 79.1 | Confident | 60 Ų | 60 | 48.7 Ų | 48.7 | 62% | 0.619 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.8 | -56.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112 | L124 M128 Q129 | L124-G126 VanDerWaalsContact C-N 3.31Å; L124-G126 PolarHBondContact O-N 3.3Å; G126-M128 VanDerWaalsContact C-N 3.31Å; G126-M128 PolarHBondContact O-N 3.47Å; G126-Q129 PolarHBondContact O-N 3.48Å; G126-Q129 VanDerWaalsContact O-N 3.1Å |
| 127 | P | 69.6 | Low | 79.1 | Confident | 74 Ų | 74 | 51 Ų | 51 | 48% | 0.481 | 34% | 0.337 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.6 | -38.9 | 175.8 | -27.6 | 32.7 | 0 | 0 | 0 | 114.6 | A60 L63 L124 Q129 | A60-P127 VanDerWaalsContact CB-O 3.29Å; A60-P127 WeakPolarHBondContact CB-O 3.4Å; L63-P127 HydrophobicContact CD2-CB 3.77Å; L124-P127 VanDerWaalsContact O-CD 3.28Å; L124-P127 WeakPolarHBondContact O-CD 3.31Å; P127-Q129 VanDerWaalsContact C-N 3.26Å; P127-Q129 PolarHBondContact O-N 2.86Å |
| 128 | M | 68.1 | Low | 79 | Confident | 4 Ų | 4 | 50.3 Ų | 50.3 | 2% | 0.02 | 34% | 0.338 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -81.4 | 0.4 | -179.7 | -70.6 | 169.6 | 59.1 | 0 | 0 | 113.5 | L63 R64 L124 G126 L130 | L63-M128 HydrophobicContact CB-CG 4.21Å; L63-M128 HydrophobicContact CD2-CG 3.63Å; L63-M128 HydrophobicContact CD2-SD 4.48Å; L63-M128 HydrophobicContact CG-CG 3.84Å; L63-M128 HydrophobicContact CG-SD 4.29Å; R64-M128 VanDerWaalsContact CA-CE 3.42Å; R64-M128 HydrophobicContact CB-CE 3.55Å; R64-M128 HydrophobicContact CG-CE 3.51Å; R64-M128 PolarHBondContact NH2-O 3.12Å; L124-M128 HydrophobicContact CB-CG 4.08Å; L124-M128 HydrophobicContact CB-SD 3.55Å; L124-M128 VanDerWaalsContact CB-SD 3.55Å; L124-M128 HydrophobicContact CD1-SD 4.34Å; L124-M128 VanDerWaalsContact O-CB 3.26Å; L124-M128 WeakPolarHBondContact O-CB 3.36Å; L124-M128 WeakPolarHBondContact O-CG 3.49Å; L124-M128 PolarHBondContact O-N 3.32Å; G126-M128 VanDerWaalsContact C-N 3.31Å; G126-M128 PolarHBondContact O-N 3.47Å; M128-L130 HydrophobicContact CB-CB 4.23Å; M128-L130 HydrophobicContact CB-CD1 4.28Å; M128-L130 HydrophobicContact CE-CD1 3.52Å; M128-L130 PolarHBondContact O-N 3.05Å; M128-L130 VanDerWaalsContact O-N 3.08Å |
| 129 | Q | 72.7 | Confident | 79.1 | Confident | 99 Ų | 99 | 51 Ų | 51 | 46% | 0.463 | 34% | 0.339 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 46.6 | 40.3 | -175.9 | -58.1 | -179.3 | 18.7 | 0 | 0 | 112.5 | R125 G126 P127 | R125-Q129 PolarHBondContact O-N 3.34Å; G126-Q129 PolarHBondContact O-N 3.48Å; G126-Q129 VanDerWaalsContact O-N 3.1Å; P127-Q129 VanDerWaalsContact C-N 3.26Å; P127-Q129 PolarHBondContact O-N 2.86Å |
| 130 | L | 72.8 | Confident | 79.3 | Confident | 24 Ų | 24 | 49.4 Ų | 49.4 | 13% | 0.126 | 34% | 0.336 | C | S | . | . | trans | -92.5 | 127.2 | -169.7 | -141.4 | 145.2 | 0 | 0 | 0 | 109.7 | R64 L121 R125 M128 A135 | R64-L130 HydrophobicContact CG-CD1 4.4Å; R64-L130 VanDerWaalsContact NE-CD1 3.32Å; L121-L130 HydrophobicContact CD2-CD1 4.35Å; L121-L130 HydrophobicContact CD2-CD2 4.22Å; R125-L130 PolarHBondContact O-N 3.19Å; R125-L130 VanDerWaalsContact O-N 3.16Å; M128-L130 HydrophobicContact CB-CB 4.23Å; M128-L130 HydrophobicContact CB-CD1 4.28Å; M128-L130 HydrophobicContact CE-CD1 3.52Å; M128-L130 PolarHBondContact O-N 3.05Å; M128-L130 VanDerWaalsContact O-N 3.08Å; L130-A135 HydrophobicContact CD2-CB 3.93Å | ||
| 131 | S | 79.2 | Confident | 79.6 | Confident | 74 Ų | 74 | 52.3 Ų | 52.3 | 52% | 0.517 | 36% | 0.36 | S | S | . | . | trans | -62.7 | 154.9 | 177.5 | 71.1 | 0 | 0 | 0 | 0 | 110.7 | A133 G134 A135 | S131-A133 PolarHBondContact O-N 3.48Å; S131-G134 PolarHBondContact O-N 3.32Å; S131-G134 PolarHBondContact OG-N 3.12Å; S131-A135 PolarHBondContact O-N 2.94Å | ||
| 132 | L | 78.3 | Confident | 79.9 | Confident | 105 Ų | 105 | 52.6 Ų | 52.6 | 55% | 0.55 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -54 | -45.4 | 174.8 | -171.1 | 74.8 | 0 | 0 | 0 | 110.3 | G134 A135 T136 | L132-G134 PolarHBondContact O-N 2.9Å; L132-A135 PolarHBondContact O-N 3.42Å; L132-T136 WeakPolarHBondContact O-CG2 3.14Å; L132-T136 PolarHBondContact O-N 3.46Å; L132-T136 PolarHBondContact O-OG1 3.43Å; L132-T136 VanDerWaalsContact O-OG1 3.13Å |
| 133 | A | 79.5 | Confident | 80.4 | Confident | 65 Ų | 65 | 54.2 Ų | 54.2 | 54% | 0.537 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -62.2 | -42.9 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | S131 A135 T136 A137 | S131-A133 PolarHBondContact O-N 3.48Å; A133-A135 VanDerWaalsContact C-N 3.29Å; A133-A135 PolarHBondContact O-N 2.97Å; A133-T136 WeakPolarHBondContact CA-OG1 3.41Å; A133-T136 PolarHBondContact O-N 2.86Å; A133-T136 PolarHBondContact O-OG1 3.48Å; A133-A137 WeakPolarHBondContact O-CB 3.47Å; A133-A137 PolarHBondContact O-N 2.83Å |
| 134 | G | 81.2 | Confident | 81.2 | Confident | 31 Ų | 31 | 55.1 Ų | 55.1 | 32% | 0.32 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -64.7 | -35.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | S131 L132 G138 | S131-G134 PolarHBondContact O-N 3.32Å; S131-G134 PolarHBondContact OG-N 3.12Å; L132-G134 PolarHBondContact O-N 2.9Å; G134-G138 PolarHBondContact O-N 3.32Å |
| 135 | A | 83.1 | Confident | 82 | Confident | 12 Ų | 12 | 55.6 Ų | 55.6 | 10% | 0.099 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -70.5 | -45 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | L121 L130 S131 L132 A133 A137 G138 V139 | L121-A135 HydrophobicContact CD2-CB 3.61Å; L130-A135 HydrophobicContact CD2-CB 3.93Å; S131-A135 PolarHBondContact O-N 2.94Å; L132-A135 PolarHBondContact O-N 3.42Å; A133-A135 VanDerWaalsContact C-N 3.29Å; A133-A135 PolarHBondContact O-N 2.97Å; A135-A137 VanDerWaalsContact C-N 3.33Å; A135-G138 PolarHBondContact O-N 3.27Å; A135-V139 WeakPolarHBondContact O-CG2 3.44Å; A135-V139 PolarHBondContact O-N 2.88Å |
| 136 | T | 84.4 | Confident | 82.8 | Confident | 87 Ų | 87 | 52 Ų | 52 | 53% | 0.534 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -65.7 | -37 | 176 | 51.8 | 0 | 0 | 0 | 0 | 111.8 | L132 A133 G140 | L132-T136 WeakPolarHBondContact O-CG2 3.14Å; L132-T136 PolarHBondContact O-N 3.46Å; L132-T136 PolarHBondContact O-OG1 3.43Å; L132-T136 VanDerWaalsContact O-OG1 3.13Å; A133-T136 WeakPolarHBondContact CA-OG1 3.41Å; A133-T136 PolarHBondContact O-N 2.86Å; A133-T136 PolarHBondContact O-OG1 3.48Å; T136-G140 PolarHBondContact O-N 3.13Å |
| 137 | A | 87 | Confident | 83.8 | Confident | 64 Ų | 64 | 54.6 Ų | 54.6 | 53% | 0.529 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -64.3 | -43.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | A133 A135 G140 A141 | A133-A137 WeakPolarHBondContact O-CB 3.47Å; A133-A137 PolarHBondContact O-N 2.83Å; A135-A137 VanDerWaalsContact C-N 3.33Å; A137-G140 PolarHBondContact O-N 3.11Å; A137-A141 WeakPolarHBondContact O-CB 3.46Å; A137-A141 PolarHBondContact O-N 3.5Å |
| 138 | G | 86.2 | Confident | 84.8 | Confident | 13 Ų | 13 | 57.1 Ų | 57.1 | 13% | 0.134 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -62 | -47.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | G134 A135 G140 A141 V142 | G134-G138 PolarHBondContact O-N 3.32Å; A135-G138 PolarHBondContact O-N 3.27Å; G138-G140 VanDerWaalsContact C-N 3.35Å; G138-G140 PolarHBondContact O-N 2.87Å; G138-A141 PolarHBondContact O-N 2.73Å; G138-V142 WeakPolarHBondContact O-CG2 3.48Å; G138-V142 PolarHBondContact O-N 3.44Å; G138-V142 VanDerWaalsContact O-N 3.1Å |
| 139 | V | 88.4 | Confident | 86 | Confident | 49 Ų | 49 | 58.8 Ų | 58.8 | 30% | 0.297 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -61.7 | -44.3 | 175.3 | 173.6 | 0 | 0 | 0 | 0 | 110.9 | A118 L121 A135 A141 V142 L143 | A118-V139 HydrophobicContact CB-CG2 4.26Å; L121-V139 HydrophobicContact CD1-CG2 4.34Å; A135-V139 WeakPolarHBondContact O-CG2 3.44Å; A135-V139 PolarHBondContact O-N 2.88Å; V139-A141 VanDerWaalsContact C-N 3.35Å; V139-A141 PolarHBondContact O-N 3.1Å; V139-V142 PolarHBondContact O-N 3.48Å; V139-L143 HydrophobicContact CG1-CD1 4Å; V139-L143 HydrophobicContact CG1-CG 4.36Å; V139-L143 WeakPolarHBondContact O-CG 3.25Å; V139-L143 PolarHBondContact O-N 3.45Å |
| 140 | G | 90 | Very high | 86.8 | Confident | 35 Ų | 35 | 56.2 Ų | 56.2 | 36% | 0.361 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -59.8 | -42.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | T136 A137 G138 V142 L143 A144 | T136-G140 PolarHBondContact O-N 3.13Å; A137-G140 PolarHBondContact O-N 3.11Å; G138-G140 VanDerWaalsContact C-N 3.35Å; G138-G140 PolarHBondContact O-N 2.87Å; G140-V142 PolarHBondContact O-N 3.44Å; G140-L143 PolarHBondContact O-N 3.17Å; G140-A144 WeakPolarHBondContact O-CB 3.44Å; G140-A144 PolarHBondContact O-N 3.48Å |
| 141 | A | 90.3 | Very high | 87.6 | Confident | 60 Ų | 60 | 58.3 Ų | 58.3 | 50% | 0.496 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -62.8 | -42.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | A137 G138 V139 A144 A145 | A137-A141 WeakPolarHBondContact O-CB 3.46Å; A137-A141 PolarHBondContact O-N 3.5Å; G138-A141 PolarHBondContact O-N 2.73Å; V139-A141 VanDerWaalsContact C-N 3.35Å; V139-A141 PolarHBondContact O-N 3.1Å; A141-A144 PolarHBondContact O-N 3.01Å; A141-A145 WeakPolarHBondContact O-CB 3.48Å; A141-A145 PolarHBondContact O-N 3.17Å |
| 142 | V | 90.3 | Very high | 88.1 | Confident | 12 Ų | 12 | 57.6 Ų | 57.6 | 7% | 0.073 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -66.4 | -40.9 | 176.6 | 170.8 | 0 | 0 | 0 | 0 | 111.9 | F71 G114 Y117 G138 V139 G140 A145 S146 | F71-V142 HydrophobicContact CD1-CG2 4.39Å; F71-V142 HydrophobicContact CD2-CG2 4.44Å; F71-V142 HydrophobicContact CE1-CG2 3.78Å; F71-V142 HydrophobicContact CE2-CB 4.47Å; F71-V142 HydrophobicContact CE2-CG1 3.83Å; F71-V142 HydrophobicContact CE2-CG2 3.84Å; F71-V142 HydrophobicContact CZ-CB 4.24Å; F71-V142 HydrophobicContact CZ-CG1 3.99Å; F71-V142 HydrophobicContact CZ-CG2 3.48Å; F71-V142 VanDerWaalsContact CZ-CG2 3.48Å; G114-V142 VanDerWaalsContact CA-CG1 3.46Å; Y117-V142 HydrophobicContact CD1-CB 4.33Å; Y117-V142 HydrophobicContact CD1-CG2 3.38Å; Y117-V142 HydrophobicContact CE1-CG2 3.53Å; Y117-V142 HydrophobicContact CG-CG2 4.25Å; G138-V142 WeakPolarHBondContact O-CG2 3.48Å; G138-V142 PolarHBondContact O-N 3.44Å; G138-V142 VanDerWaalsContact O-N 3.1Å; V139-V142 PolarHBondContact O-N 3.48Å; G140-V142 PolarHBondContact O-N 3.44Å; V142-A145 PolarHBondContact O-N 2.85Å; V142-S146 WeakPolarHBondContact O-CB 3.18Å; V142-S146 PolarHBondContact O-N 2.8Å; V142-S146 PolarHBondContact O-OG 3.08Å |
| 143 | L | 91.4 | Very high | 88.5 | Confident | 113 Ų | 113 | 53.6 Ų | 53.6 | 59% | 0.592 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -63.9 | -44.5 | 175.2 | -71.8 | 174.1 | 0 | 0 | 0 | 111.5 | V139 G140 A145 S146 L147 | V139-L143 HydrophobicContact CG1-CD1 4Å; V139-L143 HydrophobicContact CG1-CG 4.36Å; V139-L143 WeakPolarHBondContact O-CG 3.25Å; V139-L143 PolarHBondContact O-N 3.45Å; G140-L143 PolarHBondContact O-N 3.17Å; L143-A145 PolarHBondContact O-N 3.23Å; L143-S146 PolarHBondContact O-N 3.31Å; L143-L147 WeakPolarHBondContact O-CB 3.44Å; L143-L147 PolarHBondContact O-N 2.86Å |
| 144 | A | 92.8 | Very high | 88.8 | Confident | 59 Ų | 59 | 52.6 Ų | 52.6 | 49% | 0.488 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -61.5 | -44.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | G140 A141 L147 L148 | G140-A144 WeakPolarHBondContact O-CB 3.44Å; G140-A144 PolarHBondContact O-N 3.48Å; A141-A144 PolarHBondContact O-N 3.01Å; A144-L147 PolarHBondContact O-N 3.46Å; A144-L148 WeakPolarHBondContact O-CB 3.15Å; A144-L148 PolarHBondContact O-N 3.46Å |
| 145 | A | 90.6 | Very high | 89 | Confident | 27 Ų | 27 | 57.4 Ų | 57.4 | 22% | 0.223 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -64.2 | -39.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | F75 A141 V142 L143 L148 W149 | F75-A145 HydrophobicContact CE2-CB 4.11Å; F75-A145 HydrophobicContact CZ-CB 3.89Å; A141-A145 WeakPolarHBondContact O-CB 3.48Å; A141-A145 PolarHBondContact O-N 3.17Å; V142-A145 PolarHBondContact O-N 2.85Å; L143-A145 PolarHBondContact O-N 3.23Å; A145-L148 PolarHBondContact O-N 3.08Å; A145-W149 WeakPolarHBondContact O-CB 3.41Å; A145-W149 PolarHBondContact O-N 3.38Å |
| 146 | S | 91.3 | Very high | 88.8 | Confident | 26 Ų | 26 | 58.5 Ų | 58.5 | 18% | 0.182 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -67.9 | -39.7 | 176.9 | -55.1 | 0 | 0 | 0 | 0 | 111.7 | V142 L143 W149 A150 | V142-S146 WeakPolarHBondContact O-CB 3.18Å; V142-S146 PolarHBondContact O-N 2.8Å; V142-S146 PolarHBondContact O-OG 3.08Å; L143-S146 PolarHBondContact O-N 3.31Å; S146-W149 PolarHBondContact O-N 3.43Å; S146-A150 WeakPolarHBondContact O-CB 3.42Å; S146-A150 PolarHBondContact O-N 3.4Å |
| 147 | L | 92.6 | Very high | 88.3 | Confident | 114 Ų | 114 | 57 Ų | 57 | 60% | 0.597 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -66.6 | -43.6 | 175.4 | -176.9 | 65.4 | 0 | 0 | 0 | 111 | L143 A144 W149 A150 C151 | L143-L147 WeakPolarHBondContact O-CB 3.44Å; L143-L147 PolarHBondContact O-N 2.86Å; A144-L147 PolarHBondContact O-N 3.46Å; L147-W149 VanDerWaalsContact C-N 3.32Å; L147-W149 PolarHBondContact O-N 2.88Å; L147-A150 PolarHBondContact O-N 3.08Å; L147-C151 WeakPolarHBondContact O-CB 3.37Å; L147-C151 PolarHBondContact O-N 2.81Å; L147-C151 PolarHBondContact O-SG 2.93Å; L147-C151 VanDerWaalsContact O-SG 3.36Å |
| 148 | L | 91.5 | Very high | 87.7 | Confident | 127 Ų | 127 | 55.1 Ų | 55.1 | 67% | 0.665 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -59.2 | -45.1 | 175 | 177.6 | 63.8 | 0 | 0 | 0 | 111.1 | A144 A145 C151 A152 | A144-L148 WeakPolarHBondContact O-CB 3.15Å; A144-L148 PolarHBondContact O-N 3.46Å; A145-L148 PolarHBondContact O-N 3.08Å; L148-C151 PolarHBondContact O-N 3.21Å; L148-A152 WeakPolarHBondContact O-CB 3.45Å; L148-A152 PolarHBondContact O-N 3.32Å |
| 149 | W | 93.3 | Very high | 86.6 | Confident | 39 Ų | 39 | 60 Ų | 60 | 15% | 0.148 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -60.5 | -47.2 | 174.4 | 171.5 | 81 | 0 | 0 | 0 | 111.8 | S82 G107 V110 A145 S146 L147 C151 A152 V153 | S82-W149 PolarHBondContact OG-NE1 3.17Å; G107-W149 VanDerWaalsContact N-CZ2 3.29Å; V110-W149 HydrophobicContact CB-CD2 4.37Å; V110-W149 HydrophobicContact CB-CE3 4.41Å; V110-W149 HydrophobicContact CG1-CD2 4.31Å; V110-W149 HydrophobicContact CG1-CE3 4.18Å; V110-W149 HydrophobicContact CG2-CD2 4.04Å; V110-W149 HydrophobicContact CG2-CG 4.11Å; A145-W149 WeakPolarHBondContact O-CB 3.41Å; A145-W149 PolarHBondContact O-N 3.38Å; S146-W149 PolarHBondContact O-N 3.43Å; L147-W149 VanDerWaalsContact C-N 3.32Å; L147-W149 PolarHBondContact O-N 2.88Å; W149-C151 VanDerWaalsContact C-N 3.33Å; W149-C151 PolarHBondContact O-N 2.95Å; W149-A152 PolarHBondContact O-N 3.49Å; W149-V153 HydrophobicContact CD2-CG2 4.31Å; W149-V153 HydrophobicContact CH2-CG2 4.42Å; W149-V153 HydrophobicContact CZ2-CG2 3.77Å; W149-V153 WeakPolarHBondContact O-CG2 3.4Å; W149-V153 PolarHBondContact O-N 3.18Å |
| 150 | A | 89.3 | Confident | 85.2 | Confident | 44 Ų | 44 | 57.9 Ų | 57.9 | 36% | 0.364 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -63.4 | -38.7 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112 | S146 L147 G154 | S146-A150 WeakPolarHBondContact O-CB 3.42Å; S146-A150 PolarHBondContact O-N 3.4Å; L147-A150 PolarHBondContact O-N 3.08Å; A150-G154 WeakPolarHBondContact O-CA 3.4Å; A150-G154 PolarHBondContact O-N 3.38Å |
| 151 | C | 89.6 | Confident | 83.8 | Confident | 68 Ų | 68 | 63 Ų | 63 | 46% | 0.459 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -63.5 | -44.3 | 172.7 | -76 | 0 | 0 | 0 | 0 | 111.5 | L147 L148 W149 G154 L155 | L147-C151 WeakPolarHBondContact O-CB 3.37Å; L147-C151 PolarHBondContact O-N 2.81Å; L147-C151 PolarHBondContact O-SG 2.93Å; L147-C151 VanDerWaalsContact O-SG 3.36Å; L148-C151 PolarHBondContact O-N 3.21Å; W149-C151 VanDerWaalsContact C-N 3.33Å; W149-C151 PolarHBondContact O-N 2.95Å; C151-G154 PolarHBondContact O-N 3.48Å; C151-L155 WeakPolarHBondContact O-CB 3.37Å; C151-L155 VanDerWaalsContact O-CG 3.31Å; C151-L155 WeakPolarHBondContact O-CG 3.42Å; C151-L155 PolarHBondContact O-N 3.28Å |
| 152 | A | 89.8 | Confident | 82.3 | Confident | 59 Ų | 59 | 64.8 Ų | 64.8 | 49% | 0.488 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -62.4 | -45.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | L148 W149 Y156 | L148-A152 WeakPolarHBondContact O-CB 3.45Å; L148-A152 PolarHBondContact O-N 3.32Å; W149-A152 PolarHBondContact O-N 3.49Å; A152-Y156 WeakPolarHBondContact O-CB 3.33Å; A152-Y156 PolarHBondContact O-N 2.79Å; A152-Y156 VanDerWaalsContact O-N 3.08Å |
| 153 | V | 86.8 | Confident | 80.7 | Confident | 22 Ų | 22 | 68.9 Ų | 68.9 | 13% | 0.133 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -67.7 | -39.5 | 175.7 | 177.1 | 0 | 0 | 0 | 0 | 111.2 | F103 W149 Y156 M157 | F103-V153 HydrophobicContact CB-CG1 4.46Å; F103-V153 HydrophobicContact CD1-CG1 3.94Å; F103-V153 HydrophobicContact CD1-CG2 4.12Å; F103-V153 HydrophobicContact CE1-CG1 4.47Å; F103-V153 HydrophobicContact CE1-CG2 4.44Å; F103-V153 HydrophobicContact CG-CG1 4.2Å; W149-V153 HydrophobicContact CD2-CG2 4.31Å; W149-V153 HydrophobicContact CH2-CG2 4.42Å; W149-V153 HydrophobicContact CZ2-CG2 3.77Å; W149-V153 WeakPolarHBondContact O-CG2 3.4Å; W149-V153 PolarHBondContact O-N 3.18Å; V153-Y156 WeakPolarHBondContact O-CB 3.31Å; V153-Y156 PolarHBondContact O-N 2.98Å; V153-M157 HydrophobicContact CG1-CG 3.97Å; V153-M157 WeakPolarHBondContact O-CB 3.49Å; V153-M157 WeakPolarHBondContact O-CG 3.29Å; V153-M157 PolarHBondContact O-N 3.01Å |
| 154 | G | 85 | Confident | 79 | Confident | 43 Ų | 43 | 67.8 Ų | 67.8 | 44% | 0.443 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -65.1 | -43.1 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | A150 C151 Y156 M157 G158 | A150-G154 WeakPolarHBondContact O-CA 3.4Å; A150-G154 PolarHBondContact O-N 3.38Å; C151-G154 PolarHBondContact O-N 3.48Å; G154-Y156 VanDerWaalsContact C-N 3.3Å; G154-Y156 PolarHBondContact O-N 3.13Å; G154-M157 PolarHBondContact O-N 3.06Å; G154-G158 PolarHBondContact O-N 3Å |
| 155 | L | 85.2 | Confident | 77.4 | Confident | 132 Ų | 132 | 72.8 Ų | 72.8 | 69% | 0.691 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -61.9 | -41.2 | 171.9 | -72.2 | 173.1 | 0 | 0 | 0 | 110.9 | C151 G158 Q159 | C151-L155 WeakPolarHBondContact O-CB 3.37Å; C151-L155 VanDerWaalsContact O-CG 3.31Å; C151-L155 WeakPolarHBondContact O-CG 3.42Å; C151-L155 PolarHBondContact O-N 3.28Å; L155-G158 PolarHBondContact O-N 3.3Å; L155-Q159 WeakPolarHBondContact O-CG 3.31Å; L155-Q159 PolarHBondContact O-N 3.48Å; L155-Q159 VanDerWaalsContact O-N 3.08Å |
| 156 | Y | 78.4 | Confident | 75.7 | Confident | 35 Ų | 35 | 78.1 Ų | 78.1 | 14% | 0.137 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -63.4 | -48 | 177.4 | -173.6 | -100.1 | 0 | 0 | 0 | 112.4 | V86 F89 M90 F103 A152 V153 G154 G158 Q159 L160 | V86-Y156 WeakPolarHBondContact CA-OH 3.36Å; V86-Y156 HydrophobicContact CB-CE2 4.29Å; V86-Y156 HydrophobicContact CG1-CD2 4.43Å; V86-Y156 HydrophobicContact CG1-CE2 3.73Å; V86-Y156 HydrophobicContact CG2-CD1 4.34Å; V86-Y156 HydrophobicContact CG2-CD2 4.22Å; V86-Y156 HydrophobicContact CG2-CE1 4.2Å; V86-Y156 HydrophobicContact CG2-CE2 4.07Å; V86-Y156 HydrophobicContact CG2-CG 4.33Å; V86-Y156 PolarHBondContact O-OH 3.3Å; F89-Y156 HydrophobicContact CB-CE1 4.39Å; F89-Y156 WeakPolarHBondContact CB-OH 3.21Å; F89-Y156 HydrophobicContact CD1-CE1 4.47Å; F89-Y156 AromaticContact CD1-CZ 3.88Å; F89-Y156 WeakPolarHBondContact CD1-OH 3.36Å; F89-Y156 HydrophobicContact CG-CE1 4.35Å; F89-Y156 VanDerWaalsContact CG-OH 3.25Å; F89-Y156 WeakPolarHBondContact CG-OH 3.39Å; M90-Y156 HydrophobicContact CE-CE2 4.16Å; F103-Y156 HydrophobicContact CE1-CD1 4.25Å; F103-Y156 HydrophobicContact CE1-CE1 4.49Å; F103-Y156 AromaticContact CE2-CD1 3.81Å; F103-Y156 HydrophobicContact CE2-CD1 3.81Å; F103-Y156 AromaticContact CE2-CE1 3.66Å; F103-Y156 HydrophobicContact CE2-CE1 3.66Å; F103-Y156 AromaticContact CZ-CD1 3.39Å; F103-Y156 HydrophobicContact CZ-CD1 3.39Å; F103-Y156 AromaticContact CZ-CE1 3.34Å; F103-Y156 HydrophobicContact CZ-CE1 3.34Å; F103-Y156 HydrophobicContact CZ-CG 4.44Å; A152-Y156 WeakPolarHBondContact O-CB 3.33Å; A152-Y156 PolarHBondContact O-N 2.79Å; A152-Y156 VanDerWaalsContact O-N 3.08Å; V153-Y156 WeakPolarHBondContact O-CB 3.31Å; V153-Y156 PolarHBondContact O-N 2.98Å; G154-Y156 VanDerWaalsContact C-N 3.3Å; G154-Y156 PolarHBondContact O-N 3.13Å; Y156-G158 VanDerWaalsContact C-N 3.34Å; Y156-G158 PolarHBondContact O-N 3.39Å; Y156-Q159 WeakPolarHBondContact O-CB 3.35Å; Y156-Q159 PolarHBondContact O-N 3.45Å; Y156-Q159 VanDerWaalsContact O-N 3.17Å; Y156-L160 HydrophobicContact CD1-CD1 4.45Å; Y156-L160 HydrophobicContact CE1-CD1 4.33Å; Y156-L160 HydrophobicContact CE1-CD2 4.18Å; Y156-L160 HydrophobicContact CE1-CG 4.45Å; Y156-L160 WeakPolarHBondContact O-CG 3.41Å; Y156-L160 PolarHBondContact O-N 3.13Å; Y156-L160 VanDerWaalsContact O-N 3.17Å |
| 157 | M | 75.4 | Confident | 73.9 | Confident | 57 Ų | 57 | 82.1 Ų | 82.1 | 28% | 0.281 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -65.3 | -35.8 | 177 | -65 | -82.4 | -69.4 | 0 | 0 | 112.1 | Y100 F103 V153 G154 Q159 L160 E161 | Y100-M157 HydrophobicContact CD1-CE 3.64Å; Y100-M157 HydrophobicContact CD1-SD 3.84Å; Y100-M157 HydrophobicContact CE1-CE 3.35Å; Y100-M157 HydrophobicContact CE1-SD 3.59Å; Y100-M157 VanDerWaalsContact CE1-SD 3.59Å; F103-M157 HydrophobicContact CD2-SD 4.07Å; F103-M157 HydrophobicContact CE2-SD 4.35Å; V153-M157 HydrophobicContact CG1-CG 3.97Å; V153-M157 WeakPolarHBondContact O-CB 3.49Å; V153-M157 WeakPolarHBondContact O-CG 3.29Å; V153-M157 PolarHBondContact O-N 3.01Å; G154-M157 PolarHBondContact O-N 3.06Å; M157-Q159 VanDerWaalsContact C-N 3.29Å; M157-Q159 PolarHBondContact O-N 2.84Å; M157-L160 HydrophobicContact CG-CD1 4.43Å; M157-L160 WeakPolarHBondContact O-CA 3.03Å; M157-L160 WeakPolarHBondContact O-CB 3.25Å; M157-L160 PolarHBondContact O-N 3.13Å; M157-L160 HydrophobicContact SD-CD1 3.56Å; M157-L160 VanDerWaalsContact SD-CD1 3.56Å; M157-E161 PolarHBondContact O-N 3.29Å; M157-E161 VanDerWaalsContact O-N 3.11Å |
| 158 | G | 73.1 | Confident | 72 | Confident | 24 Ų | 24 | 81.4 Ų | 81.4 | 25% | 0.247 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -65.5 | -31.1 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113 | G154 L155 Y156 L160 L162 | G154-G158 PolarHBondContact O-N 3Å; L155-G158 PolarHBondContact O-N 3.3Å; Y156-G158 VanDerWaalsContact C-N 3.34Å; Y156-G158 PolarHBondContact O-N 3.39Å; G158-L160 VanDerWaalsContact C-N 3.34Å; G158-L162 WeakPolarHBondContact O-CD1 2.98Å; G158-L162 PolarHBondContact O-N 3.43Å |
| 159 | Q | 63.5 | Low | 70.2 | Confident | 114 Ų | 114 | 82.5 Ų | 82.5 | 53% | 0.533 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -67.5 | -35 | 167.9 | -63 | -67.5 | -92.7 | 0 | 0 | 111.7 | L155 Y156 M157 E161 L162 D163 | L155-Q159 WeakPolarHBondContact O-CG 3.31Å; L155-Q159 PolarHBondContact O-N 3.48Å; L155-Q159 VanDerWaalsContact O-N 3.08Å; Y156-Q159 WeakPolarHBondContact O-CB 3.35Å; Y156-Q159 PolarHBondContact O-N 3.45Å; Y156-Q159 VanDerWaalsContact O-N 3.17Å; M157-Q159 VanDerWaalsContact C-N 3.29Å; M157-Q159 PolarHBondContact O-N 2.84Å; Q159-E161 PolarHBondContact O-N 3.32Å; Q159-L162 PolarHBondContact O-N 2.95Å; Q159-D163 PolarHBondContact O-N 3.39Å |
| 160 | L | 59.5 | Low | 68.3 | Low | 5 Ų | 5 | 87.7 Ų | 87.7 | 3% | 0.026 | 50% | 0.498 | C | S | . | . | H | α-helix | trans | -60.7 | -44.9 | 175.7 | -55.6 | -177 | 0 | 0 | 0 | 112.6 | F89 Y100 Y156 M157 G158 V164 | F89-L160 HydrophobicContact CD1-CD2 3.77Å; F89-L160 HydrophobicContact CD2-CD1 4.46Å; F89-L160 HydrophobicContact CD2-CD2 3.5Å; F89-L160 HydrophobicContact CE1-CD2 3.33Å; F89-L160 HydrophobicContact CE2-CD1 4.47Å; F89-L160 HydrophobicContact CE2-CD2 3.09Å; F89-L160 HydrophobicContact CE2-CG 4.31Å; F89-L160 HydrophobicContact CG-CD2 3.85Å; F89-L160 HydrophobicContact CZ-CD2 3Å; F89-L160 HydrophobicContact CZ-CG 4.42Å; Y100-L160 HydrophobicContact CE1-CD1 4.07Å; Y156-L160 HydrophobicContact CD1-CD1 4.45Å; Y156-L160 HydrophobicContact CE1-CD1 4.33Å; Y156-L160 HydrophobicContact CE1-CD2 4.18Å; Y156-L160 HydrophobicContact CE1-CG 4.45Å; Y156-L160 WeakPolarHBondContact O-CG 3.41Å; Y156-L160 PolarHBondContact O-N 3.13Å; Y156-L160 VanDerWaalsContact O-N 3.17Å; M157-L160 HydrophobicContact CG-CD1 4.43Å; M157-L160 WeakPolarHBondContact O-CA 3.03Å; M157-L160 WeakPolarHBondContact O-CB 3.25Å; M157-L160 PolarHBondContact O-N 3.13Å; M157-L160 HydrophobicContact SD-CD1 3.56Å; M157-L160 VanDerWaalsContact SD-CD1 3.56Å; G158-L160 VanDerWaalsContact C-N 3.34Å; L160-V164 WeakPolarHBondContact O-CB 3.5Å; L160-V164 VanDerWaalsContact O-CG2 3.25Å; L160-V164 WeakPolarHBondContact O-CG2 3.1Å; L160-V164 PolarHBondContact O-N 2.88Å; L160-V164 VanDerWaalsContact O-N 3.13Å |
| 161 | E | 60 | Low | 66.6 | Low | 142 Ų | 142 | 92.8 Ų | 92.8 | 66% | 0.664 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -66.9 | -39 | -179.7 | -69.7 | 175.1 | 172.7 | 0 | 0 | 111.4 | M157 Q159 E165 | M157-E161 PolarHBondContact O-N 3.29Å; M157-E161 VanDerWaalsContact O-N 3.11Å; Q159-E161 PolarHBondContact O-N 3.32Å; E161-E165 WeakPolarHBondContact O-CB 3.37Å; E161-E165 PolarHBondContact O-N 3.48Å; E161-E165 VanDerWaalsContact O-N 3.1Å |
| 162 | L | 59.8 | Low | 64.8 | Low | 98 Ų | 98 | 93.3 Ų | 93.3 | 51% | 0.513 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -68.4 | -43.1 | 176.8 | -78.9 | 158.4 | 0 | 0 | 0 | 113.1 | G158 Q159 V164 E165 L166 | G158-L162 WeakPolarHBondContact O-CD1 2.98Å; G158-L162 PolarHBondContact O-N 3.43Å; Q159-L162 PolarHBondContact O-N 2.95Å; L162-V164 VanDerWaalsContact C-N 3.33Å; L162-E165 PolarHBondContact O-N 3.47Å; L162-L166 WeakPolarHBondContact O-CB 3.46Å; L162-L166 PolarHBondContact O-N 3.16Å; L162-L166 VanDerWaalsContact O-N 3.13Å |
| 163 | D | 56.9 | Low | 62.3 | Low | 99 Ų | 99 | 94.7 Ų | 94.7 | 53% | 0.529 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -68.2 | -32.2 | 178.2 | -81.8 | -25.2 | 0 | 0 | 0 | 112.1 | Q159 | Q159-D163 PolarHBondContact O-N 3.39Å |
| 164 | V | 55.8 | Low | 60.3 | Low | 89 Ų | 89 | 98.1 Ų | 98.1 | 54% | 0.539 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -70.7 | -40.1 | 174.1 | 169.9 | 0 | 0 | 0 | 0 | 111.5 | L160 L162 L166 | L160-V164 WeakPolarHBondContact O-CB 3.5Å; L160-V164 VanDerWaalsContact O-CG2 3.25Å; L160-V164 WeakPolarHBondContact O-CG2 3.1Å; L160-V164 PolarHBondContact O-N 2.88Å; L160-V164 VanDerWaalsContact O-N 3.13Å; L162-V164 VanDerWaalsContact C-N 3.33Å; V164-L166 VanDerWaalsContact C-N 3.32Å; V164-L166 PolarHBondContact O-N 3.17Å |
| 165 | E | 57.2 | Low | 58.2 | Low | 164 Ų | 164 | 101.5 Ų | 101.5 | 77% | 0.766 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -73.9 | -22.1 | -179.7 | -166.7 | 167.3 | 176.3 | 0 | 0 | 113 | E161 L162 | E161-E165 WeakPolarHBondContact O-CB 3.37Å; E161-E165 PolarHBondContact O-N 3.48Å; E161-E165 VanDerWaalsContact O-N 3.1Å; L162-E165 PolarHBondContact O-N 3.47Å |
| 166 | L | 55.4 | Low | 56.6 | Low | 139 Ų | 139 | 101.4 Ų | 101.4 | 73% | 0.728 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.1 | -6 | 179.4 | -125.6 | 79.8 | 0 | 0 | 0 | 115.3 | L162 V164 P168 | L162-L166 WeakPolarHBondContact O-CB 3.46Å; L162-L166 PolarHBondContact O-N 3.16Å; L162-L166 VanDerWaalsContact O-N 3.13Å; V164-L166 VanDerWaalsContact C-N 3.32Å; V164-L166 PolarHBondContact O-N 3.17Å; L166-P168 VanDerWaalsContact C-CD 3.42Å; L166-P168 WeakPolarHBondContact O-CD 3.29Å |
| 167 | V | 54.5 | Low | 54.7 | Low | 111 Ų | 111 | 108.7 Ų | 108.7 | 67% | 0.673 | 63% | 0.632 | S | S | * | * | S | Bend | trans | -93.6 | 90.3 | 163.2 | 178.3 | 0 | 0 | 0 | 0 | 106.6 | D169 | V167-D169 PolarHBondContact O-N 3.49Š|
| 168 | P | 52.8 | Low | 52.9 | Low | 98 Ų | 98 | 109.4 Ų | 109.4 | 64% | 0.636 | 65% | 0.654 | S | S | * | * | trans | -59 | 131.3 | 163.3 | 25.7 | -30.2 | 0 | 0 | 0 | 107.4 | L166 D170 | L166-P168 VanDerWaalsContact C-CD 3.42Å; L166-P168 WeakPolarHBondContact O-CD 3.29Å; P168-D170 PolarHBondContact O-N 3.36Å | ||
| 169 | D | 52.9 | Low | 51.7 | Low | 151 Ų | 151 | 114 Ų | 114 | 81% | 0.807 | 68% | 0.68 | S | S | * | * | trans | -53.8 | 91.2 | 155.5 | -104.5 | -51.3 | 0 | 0 | 0 | 106.6 | V167 D171 | V167-D169 PolarHBondContact O-N 3.49Å; D169-D171 PolarHBondContact O-N 3.37Å | ||
| 170 | D | 54 | Low | 51 | Low | 148 Ų | 148 | 116.6 Ų | 116.6 | 79% | 0.791 | 70% | 0.697 | S | S | * | * | trans | -80.6 | 65.9 | 169.4 | -161.7 | 19.6 | 0 | 0 | 0 | 108.1 | P168 | P168-D170 PolarHBondContact O-N 3.36Š| ||
| 171 | D | 53.6 | Low | 50.7 | Low | 150 Ų | 150 | 125.8 Ų | 125.8 | 80% | 0.802 | 74% | 0.74 | S | S | * | * | trans | -136.1 | 78.5 | 170.8 | -85.9 | -31.6 | 0 | 0 | 0 | 108.3 | D169 | D169-D171 PolarHBondContact O-N 3.37Š| ||
| 172 | G | 51.8 | Low | 50.3 | Low | 79 Ų | 79 | 123.7 Ų | 123.7 | 81% | 0.814 | 75% | 0.747 | S | S | * | * | trans | -169.4 | 18.9 | -176.7 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 173 | A | 36.2 | Very low | 49.9 | Very low | 89 Ų | 89 | 122.7 Ų | 122.7 | 74% | 0.736 | 76% | 0.76 | S | S | * | * | trans | -146.3 | 81.1 | 167.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | P175 | A173-P175 VanDerWaalsContact O-CD 3.29Å; A173-P175 WeakPolarHBondContact O-CD 3.45Å | ||
| 174 | A | 44.8 | Very low | 49.9 | Very low | 94 Ų | 94 | 129.4 Ų | 129.4 | 78% | 0.777 | 78% | 0.778 | S | S | * | * | trans | -71.4 | 117.2 | 149.2 | 0 | 0 | 0 | 0 | 0 | 107.8 | T176 | A174-T176 PolarHBondContact O-N 2.8Š| ||
| 175 | P | 41.5 | Very low | 50.4 | Low | 113 Ų | 113 | 130.7 Ų | 130.7 | 73% | 0.734 | 79% | 0.789 | S | S | * | * | trans | -80.4 | 107.1 | 155.1 | 28.6 | -17.7 | 0 | 0 | 0 | 106.6 | A173 E177 | A173-P175 VanDerWaalsContact O-CD 3.29Å; A173-P175 WeakPolarHBondContact O-CD 3.45Å; P175-E177 PolarHBondContact O-N 3.04Å | ||
| 176 | T | 50.7 | Low | 50.6 | Low | 131 Ų | 131 | 128.4 Ų | 128.4 | 80% | 0.804 | 79% | 0.788 | S | S | * | * | trans | -57.6 | 98.1 | 157 | 45.3 | 0 | 0 | 0 | 0 | 109.3 | A174 | A174-T176 PolarHBondContact O-N 2.8Š| ||
| 177 | E | 39.3 | Very low | 50.9 | Low | 188 Ų | 188 | 127.8 Ų | 127.8 | 88% | 0.879 | 79% | 0.792 | S | S | * | * | trans | -143.7 | 97.2 | 156.8 | -76.5 | -164.9 | 149.9 | 0 | 0 | 109.9 | P175 | P175-E177 PolarHBondContact O-N 3.04Š| ||
| 178 | G | 38.1 | Very low | 51.1 | Low | 72 Ų | 72 | 135.3 Ų | 135.3 | 74% | 0.742 | 82% | 0.82 | S | S | * | * | trans | -99.9 | 158.6 | 134.4 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 179 | P | 46.9 | Very low | 51 | Low | 120 Ų | 120 | 137.2 Ų | 137.2 | 78% | 0.779 | 83% | 0.829 | S | S | * | * | cis | -133.1 | 156.2 | 25.5 | 38.3 | -21.6 | 0 | 0 | 0 | 114.2 | ||||
| 180 | D | 49.6 | Very low | 50.9 | Low | 169 Ų | 169 | 136.4 Ų | 136.4 | 90% | 0.904 | 83% | 0.83 | S | S | * | * | trans | -147.1 | 102.4 | 149.1 | -103.2 | -21.7 | 0 | 0 | 0 | 110.2 | A182 | D180-A182 PolarHBondContact O-N 3.43Š| ||
| 181 | E | 53 | Low | 50.7 | Low | 197 Ų | 197 | 135.8 Ų | 135.8 | 92% | 0.921 | 83% | 0.832 | S | S | * | * | trans | -66.9 | 114.2 | 157.3 | -84.9 | -145.7 | 142.3 | 0 | 0 | 109.1 | ||||
| 182 | A | 50.5 | Low | 50.5 | Low | 98 Ų | 98 | 134.9 Ų | 134.9 | 81% | 0.81 | 83% | 0.834 | S | S | * | * | trans | -160.1 | 90.7 | 152.7 | 0 | 0 | 0 | 0 | 0 | 112 | D180 | D180-A182 PolarHBondContact O-N 3.43Š| ||
| 183 | G | 52.2 | Low | 50.4 | Low | 77 Ų | 77 | 138.4 Ų | 138.4 | 79% | 0.794 | 84% | 0.835 | S | S | * | * | trans | 73.1 | 96.8 | 133.7 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 184 | R | 56.8 | Low | 51.4 | Low | 241 Ų | 241 | 141.7 Ų | 141.7 | 91% | 0.909 | 84% | 0.842 | S | S | * | * | trans | -159.2 | 130.4 | 130.1 | -117.8 | -174.3 | -153.5 | -177.2 | 7.4 | 112 | ||||
| 185 | P | 65.9 | Low | 51.9 | Low | 116 Ų | 116 | 145.1 Ų | 145.1 | 75% | 0.753 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 162 | 177.1 | 29.9 | -32.8 | 0 | 0 | 0 | 113 | ||
| 186 | P | 62 | Low | 52.7 | Low | 115 Ų | 115 | 147.6 Ų | 147.6 | 75% | 0.747 | 86% | 0.855 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 162.3 | -168.4 | 29.6 | -35.9 | 0 | 0 | 0 | 114.2 | ||
| 187 | P | 62.7 | Low | 52.8 | Low | 127 Ų | 127 | 149 Ų | 149 | 83% | 0.825 | 86% | 0.86 | S | S | * | * | P | Polyproline II helix | trans | -75.1 | 149.8 | -176.3 | 31.5 | -35 | 0 | 0 | 0 | 113 | ||
| 188 | E | 57 | Low | 54.1 | Low | 268 Ų | 268 | 145.5 Ų | 145.5 | 100% | 1.252 | 86% | 0.858 | S | S | * | * | trans | -92.6 | 0 | 166.8 | -46.1 | -165.9 | -160.8 | 0 | 0 | 110.9 |
Retrieved 188 of 188 residues in 54.2 ms
(Link to these results)